rel-(5R,6R)-6-methyl-1-(2-methylpropyl)-5-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]piperidin-2-one
Chemical Structure Depiction of
rel-(5R,6R)-6-methyl-1-(2-methylpropyl)-5-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]piperidin-2-one
rel-(5R,6R)-6-methyl-1-(2-methylpropyl)-5-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]piperidin-2-one
Compound characteristics
| Compound ID: | SA17-0153 |
| Compound Name: | rel-(5R,6R)-6-methyl-1-(2-methylpropyl)-5-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]piperidin-2-one |
| Molecular Weight: | 359.47 |
| Molecular Formula: | C19 H29 N5 O2 |
| Smiles: | CC(C)CN1C(CC[C@@H](C(N2CCN(CC2)c2ncccn2)=O)[C@H]1C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1775 |
| logD: | 2.1775 |
| logSw: | -2.7406 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.605 |
| InChI Key: | YHQUQSGGQXICIV-JKSUJKDBSA-N |