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88263-94-9 | 2(1H)-Quinolinone, 4-hydroxy-1-methyl-3-[2-(phenylamino)ethyl]-
CAS No: 88263-94-9 Catalog No: AG004A6G MDL No:
Product Description
Catalog Number:
AG004A6G
Chemical Name:
2(1H)-Quinolinone, 4-hydroxy-1-methyl-3-[2-(phenylamino)ethyl]-
CAS Number:
88263-94-9
Molecular Formula:
C18H18N2O2
Molecular Weight:
294.3477
IUPAC Name:
3-(2-anilinoethyl)-4-hydroxy-1-methylquinolin-2-one
InChI:
InChI=1S/C18H18N2O2/c1-20-16-10-6-5-9-14(16)17(21)15(18(20)22)11-12-19-13-7-3-2-4-8-13/h2-10,19,21H,11-12H2,1H3
InChI Key:
CUHHFHFENQNGGB-UHFFFAOYSA-N
SMILES:
Oc1c(CCNc2ccccc2)c(=O)n(c2c1cccc2)C
Properties
Complexity:
440
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.137g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
294.354g/mol
Monoisotopic Mass:
294.137g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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