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Home > Pyridines > 303162-93-8
303162-93-8 | Benzamide, N-[4-[4-(3-methylphenyl)-2-[4-(methylthio)phenyl]-5-thiazolyl]-2-pyridinyl]-
CAS No: 303162-93-8 Catalog No: AG002ZPR MDL No:
Product Description
Catalog Number:
AG002ZPR
Chemical Name:
Benzamide, N-[4-[4-(3-methylphenyl)-2-[4-(methylthio)phenyl]-5-thiazolyl]-2-pyridinyl]-
CAS Number:
303162-93-8
Molecular Formula:
C29H23N3OS2
Molecular Weight:
493.6424
IUPAC Name:
N-[4-[4-(3-methylphenyl)-2-(4-methylthiophen-2-yl)-1,3-thiazol-5-yl]pyridin-2-yl]benzamide
InChI:
InChI=1S/C27H21N3OS2/c1-17-7-6-10-20(13-17)24-25(33-27(30-24)22-14-18(2)16-32-22)21-11-12-28-23(15-21)29-26(31)19-8-4-3-5-9-19/h3-16H,1-2H3,(H,28,29,31)
InChI Key:
HGWFCNIVBKBVIY-UHFFFAOYSA-N
SMILES:
CSc1ccc(cc1)c1sc(c(n1)c1cccc(c1)C)c1ccnc(c1)NC(=O)c1ccccc1
Properties
Complexity:
657
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
467.113g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
467.605g/mol
Monoisotopic Mass:
467.113g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
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