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89609-66-5 | 4(1H)-Quinolinone, 3-methyl-2-(phenylamino)-
CAS No: 89609-66-5 Catalog No: AG003WTT MDL No:
Product Description
Catalog Number:
AG003WTT
Chemical Name:
4(1H)-Quinolinone, 3-methyl-2-(phenylamino)-
CAS Number:
89609-66-5
Molecular Formula:
C16H14N2O
Molecular Weight:
250.2952
IUPAC Name:
2-anilino-3-methyl-1H-quinolin-4-one
InChI:
InChI=1S/C16H14N2O/c1-11-15(19)13-9-5-6-10-14(13)18-16(11)17-12-7-3-2-4-8-12/h2-10H,1H3,(H2,17,18,19)
InChI Key:
ORNGFJWEEZQCMH-UHFFFAOYSA-N
SMILES:
O=c1c(C)c(Nc2ccccc2)[nH]c2c1cccc2
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.111g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
250.301g/mol
Monoisotopic Mass:
250.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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