N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-4-methylbenzene-1-sulfonamide
N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | M071-0176 |
| Compound Name: | N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 382.48 |
| Molecular Formula: | C15 H14 N2 O4 S3 |
| Smiles: | Cc1ccc(cc1)S(Nc1ccc2c(c1)sc(n2)S(C)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9833 |
| logD: | 2.6536 |
| logSw: | -3.3956 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.132 |
| InChI Key: | XUNDGKPWXULERK-UHFFFAOYSA-N |