72X

(3R)-3-[(1S)-1-(3-chlorophenyl)-1-hydroxy-5-methoxypentyl]-N-{(1S)-2-cyclohexyl-1-[(methylamino)methyl]ethyl}piperidine-1-carboxamide


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Chemical Component Summary

Name(3R)-3-[(1S)-1-(3-chlorophenyl)-1-hydroxy-5-methoxypentyl]-N-{(1S)-2-cyclohexyl-1-[(methylamino)methyl]ethyl}piperidine-1-carboxamide
Identifiers(3R)-3-[(1S)-1-(3-chlorophenyl)-1-hydroxy-5-methoxy-pentyl]-N-[(2S)-1-cyclohexyl-3-methylamino-propan-2-yl]piperidine-1-carboxamide
FormulaC28 H46 Cl N3 O3
Molecular Weight508.136
TypeNON-POLYMER
Isomeric SMILESCNC[C@H](CC1CCCCC1)NC(=O)N2CCC[C@H](C2)[C@@](CCCCOC)(c3cccc(c3)Cl)O
InChIInChI=1S/C28H46ClN3O3/c1-30-20-26(18-22-10-4-3-5-11-22)31-27(33)32-16-9-13-24(21-32)28(34,15-6-7-17-35-2)23-12-8-14-25(29)19-23/h8,12,14,19,22,24,26,30,34H,3-7,9-11,13,15-18,20-21H2,1-2H3,(H,31,33)/t24-,26+,28-/m1/s1
InChIKeyLGUUOHMUYOBFQP-MAARLIENSA-N

Chemical Details

Formal Charge0
Atom Count81
Chiral Atom Count3
Bond Count83
Aromatic Bond Count6

Related Resource References

Resource NameReference
Pharos CHEMBL496430
PubChem 42615261
ChEMBL CHEMBL496430