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CAS 1408238-36-7 manufacturers and suppliers on PharmaCompass

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CAS 1408238-36-7
Also known as: 1-methyl-2-(4-(amino(hexyloxycarbonylimino)methyl)anilinomethyl)-1h-benzoimidazole-5-carboxylic acid ethyl ester
Molecular Formula
C26H33N5O4
Molecular Weight
479.6  g/mol
InChI Key
VHQNKPIHNBKDDL-UHFFFAOYSA-N

1 2D Structure

CAS 1408238-36-7

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
ethyl 2-[[4-(N'-hexoxycarbonylcarbamimidoyl)anilino]methyl]-1-methylbenzimidazole-5-carboxylate
2.1.2 InChI
InChI=1S/C26H33N5O4/c1-4-6-7-8-15-35-26(33)30-24(27)18-9-12-20(13-10-18)28-17-23-29-21-16-19(25(32)34-5-2)11-14-22(21)31(23)3/h9-14,16,28H,4-8,15,17H2,1-3H3,(H2,27,30,33)
2.1.3 InChI Key
VHQNKPIHNBKDDL-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CCCCCCOC(=O)N=C(C1=CC=C(C=C1)NCC2=NC3=C(N2C)C=CC(=C3)C(=O)OCC)N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 1-methyl-2-(4-(amino(hexyloxycarbonylimino)methyl)anilinomethyl)-1h-benzoimidazole-5-carboxylic Acid Ethyl Ester

2.3 Create Date
2015-07-11
3 Chemical and Physical Properties
Molecular Weight 479.6 g/mol
Molecular Formula C26H33N5O4
XLogP35.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count13
Exact Mass479.25325455 g/mol
Monoisotopic Mass479.25325455 g/mol
Topological Polar Surface Area121 Ų
Heavy Atom Count35
Formal Charge0
Complexity710
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently Bonded Unit Count1
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Hy-Gro Chemicals Pharmtek Pvt. Ltd. (Hy-Gro) is a fast growing pharmaceutical company engaged in the manu...
Hy-Gro Chemicals Pharmtek Pvt. Ltd. (Hy-Gro) is a fast growing pharmaceutical company engaged in the manufacture of Active Pharmaceutical Ingredients (APIs), Advanced Intermediates, specialized Fine Chemicals and Finished Dosages. Hy-Gro is led by a team of professional and technically proficient individuals enabling a sustainable growth trajectory for the company. We currently have 3 GMP compliant manufacturing facilities located in India. Hy-Gro was established in early 1970's as a trading company and ventured into the manufacture of bulk drugs in an associate company in 1980.
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Hy-Gro Chemicals Pharmtek Pvt. Ltd. (Hy-Gro) is a fast growing pharmaceutical company engaged in the manu...
Hy-Gro Chemicals Pharmtek Pvt. Ltd. (Hy-Gro) is a fast growing pharmaceutical company engaged in the manufacture of Active Pharmaceutical Ingredients (APIs), Advanced Intermediates, specialized Fine Chemicals and Finished Dosages. Hy-Gro is led by a team of professional and technically proficient individuals enabling a sustainable growth trajectory for the company. We currently have 3 GMP compliant manufacturing facilities located in India. Hy-Gro was established in early 1970's as a trading company and ventured into the manufacture of bulk drugs in an associate company in 1980.
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