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332859-73-1 | 2-(3-Cyano-4,6-diphenyl-pyridin-2-ylsulfanyl)-N-(4-phenyl-thiazol-2-yl)-acetamide
CAS No: 332859-73-1 Catalog No: AG01EVB8 MDL No:
Product Description
Catalog Number:
AG01EVB8
Chemical Name:
2-(3-Cyano-4,6-diphenyl-pyridin-2-ylsulfanyl)-N-(4-phenyl-thiazol-2-yl)-acetamide
CAS Number:
332859-73-1
Molecular Formula:
C29H20N4OS2
Molecular Weight:
504.6253
IUPAC Name:
2-(3-cyano-4,6-diphenylpyridin-2-yl)sulfanyl-N-(4-phenyl-1,3-thiazol-2-yl)acetamide
InChI:
InChI=1S/C29H20N4OS2/c30-17-24-23(20-10-4-1-5-11-20)16-25(21-12-6-2-7-13-21)31-28(24)35-19-27(34)33-29-32-26(18-36-29)22-14-8-3-9-15-22/h1-16,18H,19H2,(H,32,33,34)
InChI Key:
VUOSHRAGXNMXDP-UHFFFAOYSA-N
SMILES:
N#Cc1c(SCC(=O)Nc2scc(n2)c2ccccc2)nc(cc1c1ccccc1)c1ccccc1
Properties
Complexity:
754
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
504.108g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
504.626g/mol
Monoisotopic Mass:
504.108g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
132A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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