N-[2-(4-chlorophenyl)ethyl]-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide
N-[2-(4-chlorophenyl)ethyl]-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C648-0661 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 477.97 |
| Molecular Formula: | C22 H24 Cl N3 O5 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(N1CCC(CC1)C(NCCc1ccc(cc1)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5372 |
| logD: | 2.5372 |
| logSw: | -3.6769 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.07 |
| InChI Key: | OBOQUFCGLQPIBI-UHFFFAOYSA-N |