Tak-925
methyl (2R,3S)-3-(methanesulfonamido)-2-[(4-phenylcyclohexyl)oxymethyl]piperidine-1-carboxylate
Molecular Identity
Tak-925
methyl (2R,3S)-3-(methanesulfonamido)-2-[(4-phenylcyclohexyl)oxymethyl]piperidine-1-carboxylate
PubChem CID: 130310079
2D Structure
Properties
C21H32N2O5S
Molecular Formula
424.60
Molecular Weight
g/mol
424.2032
Exact Mass
Da
2.7
XLogP
Drug-like (Lipinski: < 5)
93.3
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
6
H-Bond Acceptors
621
Complexity
SMILES
Canonical SMILES
SMILES: COC(=O)N1CCCC(C1COC2CCC(CC2)C3=CC=CC=C3)NS(=O)(=O)CIsomeric SMILES
SMILES: COC(=O)N1CCC[C@@H]([C@@H]1COC2CCC(CC2)C3=CC=CC=C3)NS(=O)(=O)CSynonyms(20)
TAK-925RefChem:203192Danavorexton2114324-48-8Danavorexton [INN](2R,3S)-Methyl 3-(methylsulfonamido)-2-(((cis-4-phenylcyclohexyl)oxy)methyl)piperidine-1-carboxylate1QMD83K4YNmethyl (2R,3S)-3-(methanesulfonamido)-2-[(4-phenylcyclohexyl)oxymethyl]piperidine-1-carboxylate1-Piperidinecarboxylic acid, 3-((methylsulfonyl)amino)-2-(((cis-4-phenylcyclohexyl)oxy)methyl)-, methyl ester, (2R,3S)-Methyl (2R,3S)-3-((methylsulfonyl)amino)-2-(((cis-4-phenylcyclohexyl)oxy)methyl)piperidine-1-carboxylatemethyl (2R,3S)-3-[(methanesulfonyl)amino]-2-({[(1s,4S)-4-phenylcyclohexyl]oxy}methyl)piperidine-1-carboxylateA6FUNII-1QMD83K4YNorb1691222TAK925
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Tak-925
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