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860607-11-0 | 4(1H)-Pyridinone, 2-(4-chlorophenyl)-2,3-dihydro-1-(phenylmethyl)-
CAS No: 860607-11-0 Catalog No: AG004UBM MDL No:
Product Description
Catalog Number:
AG004UBM
Chemical Name:
4(1H)-Pyridinone, 2-(4-chlorophenyl)-2,3-dihydro-1-(phenylmethyl)-
CAS Number:
860607-11-0
Molecular Formula:
C18H16ClNO
Molecular Weight:
297.7787
IUPAC Name:
1-benzyl-2-(4-chlorophenyl)-2,3-dihydropyridin-4-one
InChI:
InChI=1S/C18H16ClNO/c19-16-8-6-15(7-9-16)18-12-17(21)10-11-20(18)13-14-4-2-1-3-5-14/h1-11,18H,12-13H2
InChI Key:
FPRPNYOBDAOCKQ-UHFFFAOYSA-N
SMILES:
O=C1C=CN(C(C1)c1ccc(cc1)Cl)Cc1ccccc1
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.092g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.782g/mol
Monoisotopic Mass:
297.092g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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