3-(3-bromo-4-methoxyphenyl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]prop-2-enamide
Chemical Structure Depiction of
3-(3-bromo-4-methoxyphenyl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]prop-2-enamide
3-(3-bromo-4-methoxyphenyl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]prop-2-enamide
Compound characteristics
| Compound ID: | 5174-3019 |
| Compound Name: | 3-(3-bromo-4-methoxyphenyl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]prop-2-enamide |
| Molecular Weight: | 467.36 |
| Molecular Formula: | C18 H15 Br N2 O4 S2 |
| Smiles: | COc1ccc(/C=C/C(Nc2nc3ccc(cc3s2)S(C)(=O)=O)=O)cc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.7939 |
| logD: | 3.7937 |
| logSw: | -4.1326 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.257 |
| InChI Key: | POWNMVMAWLRUOU-UHFFFAOYSA-N |