Shandong Loncom Pharmaceutical

CAS 1397836-41-7

Chemistry, 3 End Use API, 47 Related Intermediates

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Also known as: 1397836-41-7, Schembl17695745, Schembl17998734, Mfcd28404673, Ethyl 2-ethoxy-1-((2-(n-hydroxycarbamimidoyl)biphenyl-4-yl)methyl)-1h-benzo[d]imidazole-7-carboxylate, (z)-ethyl-2-ethoxy-3-((2-(n-hydroxycarbamimidoyl) biphenyl-4-yl) methyl)-3h-benzo[d] imidazole-4-carboxylate

Molecular Formula

C₂₆H₂₆N₄O₄

Molecular Weight

458.5 g/mol

InChI Key

DVODSSZMOBIHGO-UHFFFAOYSA-N

1 2D Structure

CAS 1397836-41-7

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

ethyl 2-ethoxy-3-[[4-[2-[(Z)-N'-hydroxycarbamimidoyl]phenyl]phenyl]methyl]benzimidazole-4-carboxylate

2.1.2 InChI

InChI=1S/C26H26N4O4/c1-3-33-25(31)21-10-7-11-22-23(21)30(26(28-22)34-4-2)16-17-12-14-18(15-13-17)19-8-5-6-9-20(19)24(27)29-32/h5-15,32H,3-4,16H2,1-2H3,(H2,27,29)

2.1.3 InChI Key

DVODSSZMOBIHGO-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCOC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=NO)N)C(=O)OCC

2.1.5 Isomeric SMILES

CCOC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4/C(=N/O)/N)C(=O)OCC

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 1397836-41-7

2. Schembl17695745

3. Schembl17998734

4. Mfcd28404673

5. Ethyl 2-ethoxy-1-((2-(n-hydroxycarbamimidoyl)biphenyl-4-yl)methyl)-1h-benzo[d]imidazole-7-carboxylate

6. (z)-ethyl-2-ethoxy-3-((2-(n-hydroxycarbamimidoyl) Biphenyl-4-yl) Methyl)-3h-benzo[d] Imidazole-4-carboxylate

7. Ethyl 2-ethoxy-1-((2'-(n'-hydroxycarbamimidoyl)biphenyl-4-yl)methyl)-1h-benzo[d]imidazole-7-carboxylate

8. Ethyl2-ethoxy-1-((2'-(n'-hydroxycarbamimidoyl)-[1,1'-biphenyl]-4-yl)methyl)-1h-benzo[d]imidazole-7-carboxylate

2.3 Create Date

2012-10-08

3 Chemical and Physical Properties

Molecular Formula	C₂₆H₂₆N₄O₄
Molecular Weight	458.5 g/mol
XLogP3	4.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	9
Exact Mass	458.19540532 g/mol
Monoisotopic Mass	458.19540532 g/mol
Topological Polar Surface Area	112 Å²
Heavy Atom Count	34
Formal Charge	0
Complexity	696
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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

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Methyl2-Ethoxy-1-((2'-(N-Hydroxycarbamimidoyl)-[1,1'-Bi...

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CAS Number

147403-65-4

End Use API

Azilsartan

About the Company

Founded in May 2012, it is a wholly-owned subsidiary of Shandong Bestcomm Pharmaceutical CO., Ltd. It is ...

Founded in May 2012, it is a wholly-owned subsidiary of Shandong Bestcomm Pharmaceutical CO., Ltd. It is located in the Qihe Economic Development Zone, Shandong Province. The API pilot test, production base, and preparation production base constructed by the company in accordance with European, American, and other international standards have been put into use, there are currently 13 production lines for oral solid preparations, oral liquid preparations, and API. The preparation workshops for small-volume injections, soft capsules, eye drops, topical medicines, and innovative drug R&D centers are being stepped up.