1-(3-chloro-2,2-dimethylpropanoyl)-N-[rel-(1R,2R)-2-(4-methoxybenzamido)cyclohexyl]piperidine-3-carboxamide
Chemical Structure Depiction of
1-(3-chloro-2,2-dimethylpropanoyl)-N-[rel-(1R,2R)-2-(4-methoxybenzamido)cyclohexyl]piperidine-3-carboxamide
1-(3-chloro-2,2-dimethylpropanoyl)-N-[rel-(1R,2R)-2-(4-methoxybenzamido)cyclohexyl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | V012-4337 |
| Compound Name: | 1-(3-chloro-2,2-dimethylpropanoyl)-N-[rel-(1R,2R)-2-(4-methoxybenzamido)cyclohexyl]piperidine-3-carboxamide |
| Molecular Weight: | 478.03 |
| Molecular Formula: | C25 H36 Cl N3 O4 |
| Smiles: | CC(C)(C[Cl])C(N1CCCC(C1)C(N[C@@H]1CCCC[C@H]1NC(c1ccc(cc1)OC)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2126 |
| logD: | 3.2126 |
| logSw: | -3.4233 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.501 |
| InChI Key: | YIYNWZGNOOJFDC-LLQWEQGGSA-N |