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834889-19-9 | 2(1H)-Quinolinone, 4-amino-3-benzoyl-
CAS No: 834889-19-9 Catalog No: AG0050NL MDL No:
Product Description
Catalog Number:
AG0050NL
Chemical Name:
2(1H)-Quinolinone, 4-amino-3-benzoyl-
CAS Number:
834889-19-9
Molecular Formula:
C16H12N2O2
Molecular Weight:
264.2787
IUPAC Name:
4-amino-3-benzoyl-1H-quinolin-2-one
InChI:
InChI=1S/C16H12N2O2/c17-14-11-8-4-5-9-12(11)18-16(20)13(14)15(19)10-6-2-1-3-7-10/h1-9H,(H3,17,18,20)
InChI Key:
DZANZGCKLDSZFC-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2ccccc2c(c1C(=O)c1ccccc1)N
Properties
Complexity:
449
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.09g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.284g/mol
Monoisotopic Mass:
264.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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