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1199556-78-9 | 1,5-Naphthyridin-2(1H)-one, 6-chloro-3-phenyl-
CAS No: 1199556-78-9 Catalog No: AG000PVW MDL No:MFCD18434510
Product Description
Catalog Number:
AG000PVW
Chemical Name:
1,5-Naphthyridin-2(1H)-one, 6-chloro-3-phenyl-
CAS Number:
1199556-78-9
Molecular Formula:
C14H9ClN2O
Molecular Weight:
256.6871
MDL Number:
MFCD18434510
IUPAC Name:
6-chloro-3-phenyl-1H-1,5-naphthyridin-2-one
InChI:
InChI=1S/C14H9ClN2O/c15-13-7-6-11-12(16-13)8-10(14(18)17-11)9-4-2-1-3-5-9/h1-8H,(H,17,18)
InChI Key:
GNCGKMPJUFFJRQ-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(n1)cc(c(=O)[nH]2)c1ccccc1
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.04g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.689g/mol
Monoisotopic Mass:
256.04g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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