N-[3-(methylsulfanyl)phenyl]-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]acetamide
N-[3-(methylsulfanyl)phenyl]-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]acetamide
Compound characteristics
| Compound ID: | F943-2079 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]acetamide |
| Molecular Weight: | 463.6 |
| Molecular Formula: | C20 H21 N3 O4 S3 |
| Smiles: | CSc1cccc(c1)NC(CN1C(=O)Sc2cc(ccc12)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8668 |
| logD: | 3.8668 |
| logSw: | -3.9348 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.038 |
| InChI Key: | OQENJDHQKBPCQO-UHFFFAOYSA-N |