3-(3,4-dimethoxyphenyl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]prop-2-enamide
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]prop-2-enamide
3-(3,4-dimethoxyphenyl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]prop-2-enamide
Compound characteristics
| Compound ID: | 5174-3010 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]prop-2-enamide |
| Molecular Weight: | 418.49 |
| Molecular Formula: | C19 H18 N2 O5 S2 |
| Smiles: | COc1ccc(/C=C/C(Nc2nc3ccc(cc3s2)S(C)(=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.0375 |
| logD: | 3.0374 |
| logSw: | -3.5961 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.887 |
| InChI Key: | VGOBQKNHRXYDIW-UHFFFAOYSA-N |