N-[3-(methylsulfanyl)phenyl]-1-(2-oxo-3-propyl-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-1-(2-oxo-3-propyl-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)piperidine-4-carboxamide
N-[3-(methylsulfanyl)phenyl]-1-(2-oxo-3-propyl-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L306-1911 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-1-(2-oxo-3-propyl-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 505.68 |
| Molecular Formula: | C23 H27 N3 O4 S3 |
| Smiles: | CCCN1C(=O)Sc2cc(ccc12)S(N1CCC(CC1)C(Nc1cccc(c1)SC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5028 |
| logD: | 4.5027 |
| logSw: | -4.1702 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.863 |
| InChI Key: | RSULHFUJMJTANU-UHFFFAOYSA-N |