N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-4-(4-methoxyphenyl)-1,2,3-thiadiazole-5-carboxamide
Chemical Structure Depiction of
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-4-(4-methoxyphenyl)-1,2,3-thiadiazole-5-carboxamide
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-4-(4-methoxyphenyl)-1,2,3-thiadiazole-5-carboxamide
Compound characteristics
| Compound ID: | Y044-0978 |
| Compound Name: | N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-4-(4-methoxyphenyl)-1,2,3-thiadiazole-5-carboxamide |
| Molecular Weight: | 446.52 |
| Molecular Formula: | C18 H14 N4 O4 S3 |
| Smiles: | COc1ccc(cc1)c1c(C(Nc2nc3ccc(cc3s2)S(C)(=O)=O)=O)snn1 |
| Stereo: | ACHIRAL |
| logP: | 2.8862 |
| logD: | 2.8848 |
| logSw: | -3.7382 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.749 |
| InChI Key: | KAUCDBGAVPPEMN-UHFFFAOYSA-N |