N-(3,4-dimethoxyphenyl)-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]acetamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]acetamide
N-(3,4-dimethoxyphenyl)-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]acetamide
Compound characteristics
| Compound ID: | F943-1958 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]acetamide |
| Molecular Weight: | 477.56 |
| Molecular Formula: | C21 H23 N3 O6 S2 |
| Smiles: | COc1ccc(cc1OC)NC(CN1C(=O)Sc2cc(ccc12)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9408 |
| logD: | 2.9407 |
| logSw: | -3.5978 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.299 |
| InChI Key: | KUGMBLQJOBWWKA-UHFFFAOYSA-N |