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792122-85-1 | 2(1H)-Quinolinone, 3,4-dihydro-1-[(4-methoxyphenyl)methyl]-3-methyl-
CAS No: 792122-85-1 Catalog No: AG008MMN MDL No:
Product Description
Catalog Number:
AG008MMN
Chemical Name:
2(1H)-Quinolinone, 3,4-dihydro-1-[(4-methoxyphenyl)methyl]-3-methyl-
CAS Number:
792122-85-1
Molecular Formula:
C18H19NO2
Molecular Weight:
281.3490
IUPAC Name:
1-[(4-methoxyphenyl)methyl]-3-methyl-3,4-dihydroquinolin-2-one
InChI:
InChI=1S/C18H19NO2/c1-13-11-15-5-3-4-6-17(15)19(18(13)20)12-14-7-9-16(21-2)10-8-14/h3-10,13H,11-12H2,1-2H3
InChI Key:
PVTOXXLOYVIXMO-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CN1C(=O)C(C)Cc2c1cccc2
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.142g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.355g/mol
Monoisotopic Mass:
281.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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