2-[1-(3-methyl-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-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidin-4-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidin-4-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | L799-0913 |
| Compound Name: | 2-[1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidin-4-yl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 475.58 |
| Molecular Formula: | C22 H25 N3 O5 S2 |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(N1CCC(CC1)CC(Nc1cccc(c1)SC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3361 |
| logD: | 3.3361 |
| logSw: | -3.9946 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.693 |
| InChI Key: | PPQGFMTZNKEEIO-UHFFFAOYSA-N |