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882854-43-5 | 4(1H)-Quinolinone, 7-bromo-2-(2,6-dimethoxyphenyl)-2,3-dihydro-
CAS No: 882854-43-5 Catalog No: AG0049TK MDL No:
Product Description
Catalog Number:
AG0049TK
Chemical Name:
4(1H)-Quinolinone, 7-bromo-2-(2,6-dimethoxyphenyl)-2,3-dihydro-
CAS Number:
882854-43-5
Molecular Formula:
C17H16BrNO3
Molecular Weight:
362.2178
IUPAC Name:
7-bromo-2-(2,6-dimethoxyphenyl)-2,3-dihydro-1H-quinolin-4-one
InChI:
InChI=1S/C17H16BrNO3/c1-21-15-4-3-5-16(22-2)17(15)13-9-14(20)11-7-6-10(18)8-12(11)19-13/h3-8,13,19H,9H2,1-2H3
InChI Key:
GCDCKNDEFSQREQ-UHFFFAOYSA-N
SMILES:
COc1cccc(c1C1CC(=O)c2c(N1)cc(cc2)Br)OC
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.031g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
362.223g/mol
Monoisotopic Mass:
361.031g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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