1-(4-tert-butylbenzene-1-sulfonyl)-N-[rel-(1R,2R)-2-(4-fluorobenzamido)cyclohexyl]piperidine-3-carboxamide
Chemical Structure Depiction of
1-(4-tert-butylbenzene-1-sulfonyl)-N-[rel-(1R,2R)-2-(4-fluorobenzamido)cyclohexyl]piperidine-3-carboxamide
1-(4-tert-butylbenzene-1-sulfonyl)-N-[rel-(1R,2R)-2-(4-fluorobenzamido)cyclohexyl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | V010-6758 |
| Compound Name: | 1-(4-tert-butylbenzene-1-sulfonyl)-N-[rel-(1R,2R)-2-(4-fluorobenzamido)cyclohexyl]piperidine-3-carboxamide |
| Molecular Weight: | 543.7 |
| Molecular Formula: | C29 H38 F N3 O4 S |
| Smiles: | CC(C)(C)c1ccc(cc1)S(N1CCCC(C1)C(N[C@@H]1CCCC[C@H]1NC(c1ccc(cc1)F)=O)=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8245 |
| logD: | 4.8245 |
| logSw: | -4.5068 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.748 |
| InChI Key: | ZIDSFJKUOVQWTI-RMFXBNNXSA-N |