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Home > Pyridines > 332375-85-6
332375-85-6 | 2-[3-Cyano-6-(4-ethoxy-phenyl)-4-phenyl-pyridin-2-ylsulfanyl]-N-phenyl-acetamide
CAS No: 332375-85-6 Catalog No: AG01EV8V MDL No:
Product Description
Catalog Number:
AG01EV8V
Chemical Name:
2-[3-Cyano-6-(4-ethoxy-phenyl)-4-phenyl-pyridin-2-ylsulfanyl]-N-phenyl-acetamide
CAS Number:
332375-85-6
Molecular Formula:
C28H23N3O2S
Molecular Weight:
465.5661
IUPAC Name:
2-[3-cyano-6-(4-ethoxyphenyl)-4-phenylpyridin-2-yl]sulfanyl-N-phenylacetamide
InChI:
InChI=1S/C28H23N3O2S/c1-2-33-23-15-13-21(14-16-23)26-17-24(20-9-5-3-6-10-20)25(18-29)28(31-26)34-19-27(32)30-22-11-7-4-8-12-22/h3-17H,2,19H2,1H3,(H,30,32)
InChI Key:
MITNDFPDMVUFMQ-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)c1nc(SCC(=O)Nc2ccccc2)c(c(c1)c1ccccc1)C#N
Properties
Complexity:
674
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
465.151g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
465.571g/mol
Monoisotopic Mass:
465.151g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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