Molecular Identity
Iniparib
4-iodo-3-nitrobenzamide
PubChem CID: 9796068
4-iodo-3-nitrobenzamide is an organohalogen compound and a carbonyl compound.
2D Structure
Properties
C7H5IN2O3
Molecular Formula
292.03
Molecular Weight
g/mol
291.9345
Exact Mass
Da
1.3
XLogP
Drug-like (Lipinski: < 5)
88.9
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
228
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])IIsomeric SMILES
SMILES: C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])ISynonyms(20)
4-Iodo-3-nitrobenzamideIniparib160003-66-7SAR240550BSI2012ZWI7KHK8FDTXSID30166784iniparibumRefChem:791040PARP-1 Inhibitor BSI-201DTXCID5089275685-396-9937799-96-7BSI-201Iniparib (BSI-201)
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Iniparib
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