(3S,5S)-3-benzyl-4-(cyclohexanecarbonyl)-1-methyl-5-{[(pyridin-3-yl)oxy]methyl}piperazin-2-one
Chemical Structure Depiction of
(3S,5S)-3-benzyl-4-(cyclohexanecarbonyl)-1-methyl-5-{[(pyridin-3-yl)oxy]methyl}piperazin-2-one
(3S,5S)-3-benzyl-4-(cyclohexanecarbonyl)-1-methyl-5-{[(pyridin-3-yl)oxy]methyl}piperazin-2-one
Compound characteristics
| Compound ID: | S972-0759 |
| Compound Name: | (3S,5S)-3-benzyl-4-(cyclohexanecarbonyl)-1-methyl-5-{[(pyridin-3-yl)oxy]methyl}piperazin-2-one |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C25 H31 N3 O3 |
| Smiles: | CN1C[C@@H](COc2cccnc2)N(C(C2CCCCC2)=O)[C@@H](Cc2ccccc2)C1=O |
| Stereo: | ABSOLUTE |
| logP: | 3.3732 |
| logD: | 3.3656 |
| logSw: | -3.227 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.669 |
| InChI Key: | HPYTVLMKRNFNHT-GGAORHGYSA-N |