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Chemistry

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Also known as: Crs-3123, Crs3123, Rep3123, Rep-3123, 2p987fw4e8, 1013915-71-3
Molecular Formula
C19H19Br2N3O2S
Molecular Weight
513.2  g/mol
InChI Key
NNTYBKTXMKBRFA-CQSZACIVSA-N
FDA UNII
2P987FW4E8

CRS3123
CRS3123 has been used in trials studying the treatment of Clostridial Infection and Clostridium Difficile Colitis.
1 2D Structure

CRS3123

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
5-[3-[[(4R)-6,8-dibromo-3,4-dihydro-2H-chromen-4-yl]amino]propylamino]-4H-thieno[3,2-b]pyridin-7-one
2.1.2 InChI
InChI=1S/C19H19Br2N3O2S/c20-11-8-12-14(2-6-26-18(12)13(21)9-11)22-4-1-5-23-17-10-16(25)19-15(24-17)3-7-27-19/h3,7-10,14,22H,1-2,4-6H2,(H2,23,24,25)/t14-/m1/s1
2.1.3 InChI Key
NNTYBKTXMKBRFA-CQSZACIVSA-N
2.1.4 Canonical SMILES
C1COC2=C(C1NCCCNC3=CC(=O)C4=C(N3)C=CS4)C=C(C=C2Br)Br
2.1.5 Isomeric SMILES
C1COC2=C([C@@H]1NCCCNC3=CC(=O)C4=C(N3)C=CS4)C=C(C=C2Br)Br
2.2 Other Identifiers
2.2.1 UNII
2P987FW4E8
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 5-((3-(((4r)-6,8-dibromo-3,4-dihydro-2h-1-benzopyran-4-yl)amino)propyl)amino)thieno(3,2-b)pyridin-7(4h)-one

2. Crs3123

3. Rep 3123

4. Rep-3123

5. Rep3123

6. Thieno(3,2-b)pyridin-7(4h)-one, 5-((3-(((4r)-6,8-dibromo-3,4-dihydro-2h-1-benzopyran-4-yl)amino)propyl)amino)-

2.3.2 Depositor-Supplied Synonyms

1. Crs-3123

2. Crs3123

3. Rep3123

4. Rep-3123

5. 2p987fw4e8

6. 1013915-71-3

7. Cid 16744283

8. 5-[(3-{[(4r)-6,8-dibromo-3,4-dihydro-2h-1-benzopyran-4-yl]amino}propyl)amino]thieno[3,2-b]pyridin-7(6h)-one

9. 5-((3-(((4r)-6,8-dibromo-3,4-dihydro-2h-1-benzopyran-4-yl)amino)propyl)amino)thieno(3,2-b)pyridin-7(4h)-one

10. 5-[(3-{[(4r)-6,8-dibromo-3,4-dihydro-2h-1-benzopyran-4-yl]amino}propyl)amino]thieno[3,2-b]pyridin-7(4h)-one

11. Schembl571285

12. Unii-2p987fw4e8

13. Chembl4297370

14. Gtpl10991

15. Zinc43173277

16. Db12262

17. Ncgc00386617-01

18. Hy-18324

19. Cs-0007431

20. Q27255381

21. Thieno(3,2-b)pyridin-7(4h)-one, 5-((3-(((4r)-6,8-dibromo-3,4-dihydro-2h-1-benzopyran-4-yl)amino)propyl)amino)-

22. U81

2.4 Create Date
2007-10-09
3 Chemical and Physical Properties
Molecular Weight 513.2 g/mol
Molecular Formula C19H19Br2N3O2S
XLogP34.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass512.95442 g/mol
Monoisotopic Mass510.95647 g/mol
Topological Polar Surface Area90.6 Ų
Heavy Atom Count27
Formal Charge0
Complexity579
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Anti-Bacterial Agents

Substances that inhibit the growth or reproduction of BACTERIA. (See all compounds classified as Anti-Bacterial Agents.)


ABOUT THIS PAGE

Looking for 1013915-71-3 / CRS3123 API manufacturers, exporters & distributors?

CRS3123 manufacturers, exporters & distributors 1

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PharmaCompass offers a list of CRS3123 API manufacturers, exporters & distributors, which can be sorted by GMP, USDMF, JDMF, KDMF, CEP (COS), WC, Price,and more, enabling you to easily find the right CRS3123 manufacturer or CRS3123 supplier for your needs.

Send us enquiries for free, and we will assist you in establishing a direct connection with your preferred CRS3123 manufacturer or CRS3123 supplier.

PharmaCompass also assists you with knowing the CRS3123 API Price utilized in the formulation of products. CRS3123 API Price is not always fixed or binding as the CRS3123 Price is obtained through a variety of data sources. The CRS3123 Price can also vary due to multiple factors, including market conditions, regulatory modifications, or negotiated pricing deals.

API | Excipient name

CRS3123

Synonyms

Crs-3123, Rep3123, Rep-3123, 2p987fw4e8, 1013915-71-3, Cid 16744283

Cas Number

1013915-71-3

Unique Ingredient Identifier (UNII)

2P987FW4E8

About CRS3123

CRS3123 has been used in trials studying the treatment of Clostridial Infection and Clostridium Difficile Colitis.

CRS3123 Manufacturers

A CRS3123 manufacturer is defined as any person or entity involved in the manufacture, preparation, processing, compounding or propagation of CRS3123, including repackagers and relabelers. The FDA regulates CRS3123 manufacturers to ensure that their products comply with relevant laws and regulations and are safe and effective to use. CRS3123 API Manufacturers are required to adhere to Good Manufacturing Practices (GMP) to ensure that their products are consistently manufactured to meet established quality criteria.

CRS3123 Suppliers

A CRS3123 supplier is an individual or a company that provides CRS3123 active pharmaceutical ingredient (API) or CRS3123 finished formulations upon request. The CRS3123 suppliers may include CRS3123 API manufacturers, exporters, distributors and traders.

click here to find a list of CRS3123 suppliers with USDMF, JDMF, KDMF, CEP, GMP, COA and API Price related information on PharmaCompass.

CRS3123 USDMF

A CRS3123 DMF (Drug Master File) is a document detailing the whole manufacturing process of CRS3123 active pharmaceutical ingredient (API) in detail. Different forms of CRS3123 DMFs exist exist since differing nations have different regulations, such as CRS3123 USDMF, ASMF (EDMF), JDMF, CDMF, etc.

A CRS3123 DMF submitted to regulatory agencies in the US is known as a USDMF. CRS3123 USDMF includes data on CRS3123's chemical properties, information on the facilities and procedures used, and details about packaging and storage. The CRS3123 USDMF is kept confidential to protect the manufacturer’s intellectual property.

click here to find a list of CRS3123 suppliers with USDMF on PharmaCompass.

CRS3123 GMP

CRS3123 Active pharmaceutical ingredient (API) is produced in GMP-certified manufacturing facility.

GMP stands for Good Manufacturing Practices, which is a system used in the pharmaceutical industry to make sure that goods are regularly produced and monitored in accordance with quality standards. The FDA’s current Good Manufacturing Practices requirements are referred to as cGMP or current GMP which indicates that the company follows the most recent GMP specifications. The World Health Organization (WHO) has its own set of GMP guidelines, called the WHO GMP. Different countries can also set their own guidelines for GMP like China (Chinese GMP) or the EU (EU GMP).

PharmaCompass offers a list of CRS3123 GMP manufacturers, exporters & distributors, which can be sorted by USDMF, JDMF, KDMF, CEP (COS), WC, API price, and more, enabling you to easily find the right CRS3123 GMP manufacturer or CRS3123 GMP API supplier for your needs.

CRS3123 CoA

A CRS3123 CoA (Certificate of Analysis) is a formal document that attests to CRS3123's compliance with CRS3123 specifications and serves as a tool for batch-level quality control.

CRS3123 CoA mostly includes findings from lab analyses of a specific batch. For each CRS3123 CoA document that a company creates, the USFDA specifies specific requirements, such as supplier information, material identification, transportation data, evidence of conformity and signature data.

CRS3123 may be tested according to a variety of international standards, such as European Pharmacopoeia (CRS3123 EP), CRS3123 JP (Japanese Pharmacopeia) and the US Pharmacopoeia (CRS3123 USP).

Inform the supplier about your product requirements, specifying if you need a product with particular monograph like EP (Ph. Eur.), USP, JP, BP, or any other quality. In addition, clarify whether you need hydrochloride (HCl), anhydricum, base, micronisatum or a specific level of purity. To find reputable suppliers, utilize the filters and select those certified by GMP, FDA, or any other certification as per your requirement.
For your convenience, we have listed synonyms and CAS numbers to help you find the best supplier. The use of synonyms and CAS numbers can be helpful in identifying potential suppliers, but it is crucial to note that they might not always indicate the exact same product. It is important to confirm the product details with the supplier before making a purchase to ensure that it meets your requirements.
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