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Also known as: 147403-65-4, Schembl16367902, Amy4361, Dtxsid10570360, Mfcd21496678, Akos016004226
Molecular Formula
C25H24N4O4
Molecular Weight
444.5  g/mol
InChI Key
OQJREYQHKLULTR-UHFFFAOYSA-N

CAS 147403-65-4
1 2D Structure

CAS 147403-65-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
methyl 2-ethoxy-3-[[4-[2-[(Z)-N'-hydroxycarbamimidoyl]phenyl]phenyl]methyl]benzimidazole-4-carboxylate
2.1.2 InChI
InChI=1S/C25H24N4O4/c1-3-33-25-27-21-10-6-9-20(24(30)32-2)22(21)29(25)15-16-11-13-17(14-12-16)18-7-4-5-8-19(18)23(26)28-31/h4-14,31H,3,15H2,1-2H3,(H2,26,28)
2.1.3 InChI Key
OQJREYQHKLULTR-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CCOC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=NO)N)C(=O)OC
2.1.5 Isomeric SMILES
CCOC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4/C(=N/O)/N)C(=O)OC
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 147403-65-4

2. Schembl16367902

3. Amy4361

4. Dtxsid10570360

5. Mfcd21496678

6. Akos016004226

7. Ds-3760

8. 1h-benzimidazole-7-carboxylic Acid, 2-ethoxy-1-[[2'-[(hydroxyamino)iminomethyl][1,1'-biphenyl]-4-yl]methyl]-, Methyl Ester

9. Ac-25906

10. (z)-methyl 2-ethoxy-3-((2-(n-hydroxycarbamimidoyl)biphenyl-4-yl)methyl)-3h-benzo[d] Imidazole-4-carboxylate

11. Methyl 2-ethoxy-1-{[2'-(n'-hydroxycarbamimidoyl)[1,1'-biphenyl]-4-yl]methyl}-1h-benzimidazole-7-carboxylate

12. Methyl 2-ethoxy-3-[[4-[2-[(z)-n\'-hydroxycarbamimidoyl]phenyl]phenyl]methyl]benzimidazole-4-carboxylate

2.3 Create Date
2007-02-09
3 Chemical and Physical Properties
Molecular Weight 444.5 g/mol
Molecular Formula C25H24N4O4
XLogP34.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass444.17975526 g/mol
Monoisotopic Mass444.17975526 g/mol
Topological Polar Surface Area112 Ų
Heavy Atom Count33
Formal Charge0
Complexity681
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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01

  • fda
  • EDQM
  • WHO-GMP

Virtual BoothShandong Loncom is an R&D-focused manufacturer of Anti-cancer APIs.

methyl (Z)-2-ethoxy-1-((2'-(N'-hydroxycar bamimido...

CAS Number : 147403-65-4

End Use API :

About the Company : Established in May 2012, Shandong Loncom Pharmaceutical operates as a fully owned subsidiary of Shandong Bestcomm Pharmaceutical Co., Ltd. Situated in the Qihe Economic Development Zone...

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02

  • fda
  • EDQM
  • WHO-GMP

Virtual BoothShandong Loncom is an R&D-focused manufacturer of Anti-cancer APIs.

Methyl2-ethoxy-1-((2'-(N-hydroxycarbamimidoyl)-[1,...

CAS Number : 147403-65-4

End Use API :

About the Company : Established in May 2012, Shandong Loncom Pharmaceutical operates as a fully owned subsidiary of Shandong Bestcomm Pharmaceutical Co., Ltd. Situated in the Qihe Economic Development Zone...

Shandong Loncom Pharmaceutical company banner

03

APGA Annual Conference
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Almelo

India
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Methyl-2-Ethoxy-1-[[2’- Hydroxycarbamimidoyl) Bi...

CAS Number : CAS-147403-65-4

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About the Company : Almelo are the industry leaders in manufacturing advanced intermediates, Active Pharmaceutical Ingredients (APIs) and specialty fine chemicals. With a diverse product portfolio coupled ...

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04

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1H-Benzimidazole-7-carboxylic acid, 2-ethoxy-1-[[2...

CAS Number : 147403-65-4

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About the Company : CTX is one of the youngest and fastest-growing Indian API and Intermediate manufacturing companies doing business in over 70 countries. In these five years, all my thoughts and actions ...

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05

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Methyl 2-ethoxy [[2`- (hydroxyamidino)biphenyl-4-y...

CAS Number : 147403-65-4

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About the Company : Smilax Laboratories Limited is a research-driven, vertically integrated pharmaceutical company manufacturing Active Pharmaceutical Ingredients, API Intermediates and NDDS/Pellets for th...

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06

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(Z)-Methyl 2-ethoxy-3-((2'-(N'-hydroxycarbaMiMidoy...

CAS Number : 147403-65-4

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About the Company : Zhuhai Rundu Pharmaceutical Co., Ltd. is a modern scientific and technological pharmaceutical enterprise integrating drug research and development, production, and sales. It is located ...

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