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148244-91-1 | 1,8-Naphthyridin-2(1H)-one, 1-methyl-3-phenyl-
CAS No: 148244-91-1 Catalog No: AG001FJF MDL No:
Product Description
Catalog Number:
AG001FJF
Chemical Name:
1,8-Naphthyridin-2(1H)-one, 1-methyl-3-phenyl-
CAS Number:
148244-91-1
Molecular Formula:
C15H12N2O
Molecular Weight:
236.2686
IUPAC Name:
1-methyl-3-phenyl-1,8-naphthyridin-2-one
InChI:
InChI=1S/C15H12N2O/c1-17-14-12(8-5-9-16-14)10-13(15(17)18)11-6-3-2-4-7-11/h2-10H,1H3
InChI Key:
XJMXZQVIWNNCRV-UHFFFAOYSA-N
SMILES:
O=c1c(cc2c(n1C)nccc2)c1ccccc1
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.274g/mol
Monoisotopic Mass:
236.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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