Bomedemstat
N-[(2S)-5-[[(1R,2S)-2-(4-fluorophenyl)cyclopropyl]amino]-1-(4-methylpiperazin-1-yl)-1-oxopentan-2-yl]-4-(triazol-1-yl)benzamide
Molecular Identity
Bomedemstat
N-[(2S)-5-[[(1R,2S)-2-(4-fluorophenyl)cyclopropyl]amino]-1-(4-methylpiperazin-1-yl)-1-oxopentan-2-yl]-4-(triazol-1-yl)benzamide
PubChem CID: 122460381
2D Structure
Properties
C28H34FN7O2
Molecular Formula
519.60
Molecular Weight
g/mol
519.2758
Exact Mass
Da
2.3
XLogP
Drug-like (Lipinski: < 5)
95.4
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
7
H-Bond Acceptors
779
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Bomedemstat1990504-34-1IMG-7289Bomedemstat [USAN]Y2T4ALDEATUNII-Y2T4ALDEATBOMEDEMSTAT [INN]BOMEDEMSTAT [WHO-DD]N-((1S)-4-(((1R,2S)-2-(4-FLUOROPHENYL)CYCLOPROPYL)AMINO)-1-((4-METHYL-1-PIPERAZINYL)CARBONYL)BUTYL)-4-(1H-1,2,3-TRIAZOL-1-YL)BENZAMIDEN-[(2S)-5-{[(1R,2S)-2-(4-fluorophenyl)cyclopropyl]amino}-1-(4-methylpiperazin-1-yl)-1-oxopentan-2-yl]-4-(1H-1,2,3-triazol-1-yl)benzamideN-((2S)-5-(((1R,2S)-2-(4-fluorophenyl)cyclopropyl)amino)-1-(4-methylpiperazin-1-yl)-1-oxopentan-2-yl)-4-(1H-1,2,3-triazol-1-yl)benzamideRefChem:120936LSD-1 Inhibitor IMG-7289IMG 7289Lysine-specific Demethylase 1 Inhibitor IMG-7289
Data from PubChem (NCBI)
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