Chemical Component Summary

Name(3S,5R)-5-[4-(2-chlorophenyl)-2,2-dimethyl-5-oxopiperazin-1-yl]-N-(2,6-dimethylheptan-4-yl)piperidine-3-carboxamide
Identifiers(3S,5R)-5-[4-(2-chlorophenyl)-2,2-dimethyl-5-oxidanylidene-piperazin-1-yl]-N-(2,6-dimethylheptan-4-yl)piperidine-3-carboxamide
FormulaC27 H43 Cl N4 O2
Molecular Weight491.109
TypeNON-POLYMER
Isomeric SMILESCC(C)CC(CC(C)C)NC(=O)[C@H]1C[C@H](CNC1)N2CC(=O)N(CC2(C)C)c3ccccc3Cl
InChIInChI=1S/C27H43ClN4O2/c1-18(2)11-21(12-19(3)4)30-26(34)20-13-22(15-29-14-20)32-16-25(33)31(17-27(32,5)6)24-10-8-7-9-23(24)28/h7-10,18-22,29H,11-17H2,1-6H3,(H,30,34)/t20-,22+/m0/s1
InChIKeyVVEBLTKFUFYNOR-RBBKRZOGSA-N

Chemical Details

Formal Charge0
Atom Count77
Chiral Atom Count2
Bond Count79
Aromatic Bond Count6

Related Resource References

Resource NameReference
PubChem 70679351
ChEMBL CHEMBL2220069