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792122-32-8 | 2(1H)-Quinolinone, 3,4-dihydro-3-[2-(methylamino)ethyl]-1-phenyl-
CAS No: 792122-32-8 Catalog No: AG00534V MDL No:
Product Description
Catalog Number:
AG00534V
Chemical Name:
2(1H)-Quinolinone, 3,4-dihydro-3-[2-(methylamino)ethyl]-1-phenyl-
CAS Number:
792122-32-8
Molecular Formula:
C18H20N2O
Molecular Weight:
280.3642
IUPAC Name:
3-[2-(methylamino)ethyl]-1-phenyl-3,4-dihydroquinolin-2-one
InChI:
InChI=1S/C18H20N2O/c1-19-12-11-15-13-14-7-5-6-10-17(14)20(18(15)21)16-8-3-2-4-9-16/h2-10,15,19H,11-13H2,1H3
InChI Key:
VROMWSWPRNOJJN-UHFFFAOYSA-N
SMILES:
CNCCC1Cc2ccccc2N(C1=O)c1ccccc1
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.158g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
280.371g/mol
Monoisotopic Mass:
280.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Literature
| Title | Journal |
|---|---|
| 1-Aryl-3,4-dihydro-1H-quinolin-2-one derivatives, novel and selective norepinephrine reuptake inhibitors. | Bioorganic & medicinal chemistry letters 20051015 |
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