N-[rel-(1R,2R)-2-benzamidocyclohexyl]-1-(4-bromobenzene-1-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,2R)-2-benzamidocyclohexyl]-1-(4-bromobenzene-1-sulfonyl)piperidine-4-carboxamide
N-[rel-(1R,2R)-2-benzamidocyclohexyl]-1-(4-bromobenzene-1-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | V005-7887 |
| Compound Name: | N-[rel-(1R,2R)-2-benzamidocyclohexyl]-1-(4-bromobenzene-1-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 548.5 |
| Molecular Formula: | C25 H30 Br N3 O4 S |
| Smiles: | C1CC[C@H]([C@@H](C1)NC(C1CCN(CC1)S(c1ccc(cc1)[Br])(=O)=O)=O)NC(c1ccccc1)=O |
| Stereo: | RELATIVE |
| logP: | 3.8135 |
| logD: | 3.8135 |
| logSw: | -3.9266 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.815 |
| InChI Key: | LHJYRFVKRPKIOB-GOTSBHOMSA-N |