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573696-33-0 | 3-(anilinomethyl)-7-methylquinolin-2(1H)-one
CAS No: 573696-33-0 Catalog No: AG00IA7Z MDL No:MFCD04072102
Product Description
Catalog Number:
AG00IA7Z
Chemical Name:
3-(anilinomethyl)-7-methylquinolin-2(1H)-one
CAS Number:
573696-33-0
Molecular Formula:
C17H16N2O
Molecular Weight:
264.3217
MDL Number:
MFCD04072102
IUPAC Name:
3-(anilinomethyl)-7-methyl-1H-quinolin-2-one
InChI:
InChI=1S/C17H16N2O/c1-12-7-8-13-10-14(17(20)19-16(13)9-12)11-18-15-5-3-2-4-6-15/h2-10,18H,11H2,1H3,(H,19,20)
InChI Key:
SODLSWDULAPYEM-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)[nH]c(=O)c(c2)CNc1ccccc1
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.126g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.328g/mol
Monoisotopic Mass:
264.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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