2-[1-(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidin-4-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[1-(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidin-4-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[1-(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidin-4-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | L799-1699 |
| Compound Name: | 2-[1-(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidin-4-yl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 489.61 |
| Molecular Formula: | C23 H27 N3 O5 S2 |
| Smiles: | CCN1C(=O)Oc2cc(ccc12)S(N1CCC(CC1)CC(Nc1cccc(c1)SC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8374 |
| logD: | 3.8374 |
| logSw: | -4.0942 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.652 |
| InChI Key: | ZCNROPKSQDWHOG-UHFFFAOYSA-N |