1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-N-[4-(trifluoromethoxy)phenyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-N-[4-(trifluoromethoxy)phenyl]piperidine-4-carboxamide
1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-N-[4-(trifluoromethoxy)phenyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C648-0831 |
| Compound Name: | 1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-N-[4-(trifluoromethoxy)phenyl]piperidine-4-carboxamide |
| Molecular Weight: | 499.46 |
| Molecular Formula: | C21 H20 F3 N3 O6 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(N1CCC(CC1)C(Nc1ccc(cc1)OC(F)(F)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2713 |
| logD: | 3.2713 |
| logSw: | -3.8837 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.843 |
| InChI Key: | ZUGYDDKFHSKEQE-UHFFFAOYSA-N |