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157263-00-8

157263-00-8 | Benzamide, N-[[4'-[(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl][1,1'-biphenyl]-2-yl]sulfonyl]-

CAS No: 157263-00-8 Catalog No: AG001PC6 MDL No:

Product Description

Catalog Number:
AG001PC6
Chemical Name:
Benzamide, N-[[4'-[(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl][1,1'-biphenyl]-2-yl]sulfonyl]-
CAS Number:
157263-00-8
Molecular Formula:
C30H28N4O3S
Molecular Weight:
524.6333
IUPAC Name:
N-[2-[4-[(2-ethyl-5,7-dimethylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]phenyl]sulfonylbenzamide
InChI:
InChI=1S/C30H28N4O3S/c1-4-27-32-28-20(2)18-21(3)31-29(28)34(27)19-22-14-16-23(17-15-22)25-12-8-9-13-26(25)38(36,37)33-30(35)24-10-6-5-7-11-24/h5-18H,4,19H2,1-3H3,(H,33,35)
InChI Key:
LIUNMFCWFYFUGQ-UHFFFAOYSA-N
SMILES:
CCc1nc2c(n1Cc1ccc(cc1)c1ccccc1S(=O)(=O)NC(=O)c1ccccc1)nc(cc2C)C

Properties

Complexity:
894  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
524.188g/mol
Formal Charge:
0
Heavy Atom Count:
38  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
524.639g/mol
Monoisotopic Mass:
524.188g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9  

Literature

Title Journal
Angiotensin II receptor type 1 (AT1) selective nonpeptidic antagonists--a perspective. Bioorganic & medicinal chemistry 20101215
Early imaging in heart failure: exploring novel molecular targets. Journal of nuclear cardiology : official publication of the American Society of Nuclear Cardiology 20070101
Nonpeptide angiotensin II receptor antagonists: the next generation in antihypertensive therapy. Journal of medicinal chemistry 19960202

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