1-(3,3-dimethylbutanoyl)-N-[rel-(1R,2R)-2-(2-methylbenzamido)cyclohexyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(3,3-dimethylbutanoyl)-N-[rel-(1R,2R)-2-(2-methylbenzamido)cyclohexyl]piperidine-4-carboxamide
1-(3,3-dimethylbutanoyl)-N-[rel-(1R,2R)-2-(2-methylbenzamido)cyclohexyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | V013-0130 |
| Compound Name: | 1-(3,3-dimethylbutanoyl)-N-[rel-(1R,2R)-2-(2-methylbenzamido)cyclohexyl]piperidine-4-carboxamide |
| Molecular Weight: | 441.61 |
| Molecular Formula: | C26 H39 N3 O3 |
| Smiles: | Cc1ccccc1C(N[C@@H]1CCCC[C@H]1NC(C1CCN(CC1)C(CC(C)(C)C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.7596 |
| logD: | 3.7596 |
| logSw: | -3.8663 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.496 |
| InChI Key: | HLAJRGDCSIJRIO-VXKWHMMOSA-N |