Implitapide
(2S)-2-cyclopentyl-2-[3-[(2,4-dimethylpyrido[2,3-b]indol-9-yl)methyl]phenyl]-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide
Molecular Identity
Implitapide
(2S)-2-cyclopentyl-2-[3-[(2,4-dimethylpyrido[2,3-b]indol-9-yl)methyl]phenyl]-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide
PubChem CID: 5745206
2D Structure
Properties
C35H37N3O2
Molecular Formula
531.70
Molecular Weight
g/mol
531.2886
Exact Mass
Da
7.3
XLogP
Above Lipinski threshold
67.2
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
3
H-Bond Acceptors
823
Complexity
SMILES
Canonical SMILES
SMILES: CC1=CC(=NC2=C1C3=CC=CC=C3N2CC4=CC(=CC=C4)C(C5CCCC5)C(=O)NC(CO)C6=CC=CC=C6)CIsomeric SMILES
SMILES: CC1=CC(=NC2=C1C3=CC=CC=C3N2CC4=CC(=CC=C4)[C@H](C5CCCC5)C(=O)N[C@@H](CO)C6=CC=CC=C6)CSynonyms(20)
implitapidaQ70OH404HRBAY-13-9952DTXSID70870136(2S)-2-cyclopentyl-2-(4-((2,4-dimethyl-9H-pyrido(2,3-b)indol-9-yl)methyl)phenyl)-N-((1S)-2-hydroxy-1-phenylethyl)ethanamideimplitapidum(2S)-2-cyclopentyl-2-(3-((2,4-dimethyl-9H-pyrido(2,3-b)indol-9-yl)methyl)phenyl)-N-((1R)-2-hydroxy-1-phenylethyl)acetamide(2S)-2-Cyclopentyl-2-{3-[(2,4-dimethyl-9H-pyrido[2,3-b]indol-9-yl)methyl]phenyl}-N-[(1R)-2-hydroxy-1-phenylethyl]acetamideRefChem:148047DTXCID001511301177469-96-4ImplitapideImplitapide [INN](2S)-2-cyclopentyl-2-[3-[(2,4-dimethylpyrido[2,3-b]indol-9-yl)methyl]phenyl]-N-[(1R)-2-hydroxy-1-phenylethyl]acetamideIMPLITAPIDE [WHO-DD]
Data from PubChem (NCBI)
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