Semaxanib
(3Z)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-1H-indol-2-one
Molecular Identity
Semaxanib
(3Z)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-1H-indol-2-one
PubChem CID: 5329098
Semaxanib is an oxindole that is 3-methyleneoxindole in which one of the hydrogens of the methylene group is replaced by a 3,5-dimethylpyrrol-2-yl group. It has a role as an antineoplastic agent, an angiogenesis modulating agent, an EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor and a vascular endothelial growth factor receptor antagonist. It is a member of pyrroles, a member of oxindoles and an olefinic compound. It is functionally related to a 3-methyleneoxindole.
2D Structure
Properties
C15H14N2O
Molecular Formula
238.28
Molecular Weight
g/mol
238.1106
Exact Mass
Da
2.5
XLogP
Drug-like (Lipinski: < 5)
44.9
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
1
H-Bond Acceptors
377
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Semaxanib194413-58-6SU5416SU 5416SemoxindSemaxanib (SU5416)SU-5416(Z)-3-((3,5-dimethyl-1H-pyrrol-2-yl)methylene)indolin-2-oneTSU 16Z-Semaxanib(3Z)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-1H-indol-2-oneNSC-696819MFCD09763655(Z)-SU 54163-[(2,4-Dimethylpyrrol-5-yl)methylidenyl]-2-indolinon
Data from PubChem (NCBI)
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