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Home > Indoles and Oxindole > 935269-26-4
935269-26-4 | 1H-Isoindole-4-carboxaMide, 2,3-dihydro-3-oxo-
CAS No: 935269-26-4 Catalog No: AG00IHNI MDL No:MFCD13177837
Product Description
Catalog Number:
AG00IHNI
Chemical Name:
1H-Isoindole-4-carboxaMide, 2,3-dihydro-3-oxo-
CAS Number:
935269-26-4
MDL Number:
MFCD13177837
IUPAC Name:
3-oxo-1,2-dihydroisoindole-4-carboxamide
InChI:
InChI=1S/C9H8N2O2/c10-8(12)6-3-1-2-5-4-11-9(13)7(5)6/h1-3H,4H2,(H2,10,12)(H,11,13)
InChI Key:
LTNBJPASIMOEQG-UHFFFAOYSA-N
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
176.175g/mol
Monoisotopic Mass:
176.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
Literature
| Title | Journal |
|---|---|
| Discovery and SAR of substituted 3-oxoisoindoline-4-carboxamides as potent inhibitors of poly(ADP-ribose) polymerase (PARP) for the treatment of cancer. | Bioorganic & medicinal chemistry letters 20100201 |
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