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114227-10-0 | 4(1H)-Pyridinone, 1-(2-chlorophenyl)-3-ethyl-2,6-diphenyl-
CAS No: 114227-10-0 Catalog No: AG000AWA MDL No:
Product Description
Catalog Number:
AG000AWA
Chemical Name:
4(1H)-Pyridinone, 1-(2-chlorophenyl)-3-ethyl-2,6-diphenyl-
CAS Number:
114227-10-0
Molecular Formula:
C25H20ClNO
Molecular Weight:
385.8854
IUPAC Name:
1-(2-chlorophenyl)-3-ethyl-2,6-diphenylpyridin-4-one
InChI:
InChI=1S/C25H20ClNO/c1-2-20-24(28)17-23(18-11-5-3-6-12-18)27(22-16-10-9-15-21(22)26)25(20)19-13-7-4-8-14-19/h3-17H,2H2,1H3
InChI Key:
XYXCWHWPQIEKPQ-UHFFFAOYSA-N
SMILES:
CCc1c(=O)cc(n(c1c1ccccc1)c1ccccc1Cl)c1ccccc1
Properties
Complexity:
625
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.123g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
385.891g/mol
Monoisotopic Mass:
385.123g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
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