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109722-74-9 | 5H-Indeno[1,2-c]isoquinolin-5-one, 6,11-dihydro-
CAS No: 109722-74-9 Catalog No: AG00824G MDL No:
Product Description
Catalog Number:
AG00824G
Chemical Name:
5H-Indeno[1,2-c]isoquinolin-5-one, 6,11-dihydro-
CAS Number:
109722-74-9
Molecular Formula:
C16H11NO
Molecular Weight:
233.2646
IUPAC Name:
6,11-dihydroindeno[1,2-c]isoquinolin-5-one
InChI:
InChI=1S/C16H11NO/c18-16-13-8-4-3-7-12(13)14-9-10-5-1-2-6-11(10)15(14)17-16/h1-8H,9H2,(H,17,18)
InChI Key:
MOPKKHSEOPGEBJ-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2c3ccccc3Cc2c2c1cccc2
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.084g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.27g/mol
Monoisotopic Mass:
233.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Discovery of potent poly(ADP-ribose) polymerase-1 inhibitors from the modification of indeno[1,2-c]isoquinolinone. | Journal of medicinal chemistry 20050811 |
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