N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-4-(propan-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-4-(propan-2-yl)benzene-1-sulfonamide
N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-4-(propan-2-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | M071-0231 |
| Compound Name: | N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-4-(propan-2-yl)benzene-1-sulfonamide |
| Molecular Weight: | 410.53 |
| Molecular Formula: | C17 H18 N2 O4 S3 |
| Smiles: | CC(C)c1ccc(cc1)S(Nc1ccc2c(c1)sc(n2)S(C)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8981 |
| logD: | 3.5684 |
| logSw: | -3.9806 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.132 |
| InChI Key: | KDGMPAIHETVZED-UHFFFAOYSA-N |