1-(3-ethyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)-N-[3-(methylsulfanyl)phenyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(3-ethyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)-N-[3-(methylsulfanyl)phenyl]piperidine-4-carboxamide
1-(3-ethyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)-N-[3-(methylsulfanyl)phenyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L306-0913 |
| Compound Name: | 1-(3-ethyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)-N-[3-(methylsulfanyl)phenyl]piperidine-4-carboxamide |
| Molecular Weight: | 491.65 |
| Molecular Formula: | C22 H25 N3 O4 S3 |
| Smiles: | CCN1C(=O)Sc2cc(ccc12)S(N1CCC(CC1)C(Nc1cccc(c1)SC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0134 |
| logD: | 4.0134 |
| logSw: | -3.981 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.61 |
| InChI Key: | ZNOQJVBONCYJBD-UHFFFAOYSA-N |