BAY-2402234
N-(2-chloro-6-fluorophenyl)-4-[4-ethyl-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-5-fluoro-2-[(2S)-1,1,1-trifluoropropan-2-yl]oxybenzamide
Molecular Identity
BAY-2402234
N-(2-chloro-6-fluorophenyl)-4-[4-ethyl-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-5-fluoro-2-[(2S)-1,1,1-trifluoropropan-2-yl]oxybenzamide
PubChem CID: 134470179
2D Structure
Properties
C21H18ClF5N4O4
Molecular Formula
520.80
Molecular Weight
g/mol
520.0937
Exact Mass
Da
4
XLogP
Drug-like (Lipinski: < 5)
94.5
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
10
H-Bond Acceptors
819
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
BAY-24022342225819-06-5OrludodstatBAY 2402234X8GF945GMKBAY2402234N-(2-chloro-6-fluorophenyl)-4-[4-ethyl-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-5-fluoro-2-[(2S)-1,1,1-trifluoropropan-2-yl]oxybenzamideN-(2-Chloro-6-fluorophenyl)-4-(4-ethyl-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)-5-fluoro-2-(((2S)-1,1,1-trifluoropropan-2-yl)oxy)benzamideN-(2-chloro-6-fluorophenyl)-4-[4-ethyl-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-5-fluoro-2-{[(2S)-1,1,1-trifluoropropan-2-yl]oxy}benzamideN-(2-chloro-6-fluorophenyl)-4-(4-ethyl-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl)-5-fluoro-2-((2S)-1,1,1-trifluoropropan-2-yl)oxybenzamideRefChem:168548DHODH Inhibitor BAY2402234Dihydroorotate Dehydrogenase Inhibitor BAY2402234(S)-N-(2-Chloro-6-fluorophenyl)-4-(4-ethyl-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)-5-fluoro-2-((1,1,1-trifluoropropan-2-yl)oxy)benzamideOrludodstat(inn)
Data from PubChem (NCBI)
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