N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
Chemical Structure Depiction of
N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
Compound characteristics
| Compound ID: | M071-0088 |
| Compound Name: | N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C14 H16 N4 O4 S3 |
| Smiles: | CCS(c1nc2ccc(cc2s1)NS(c1c(C)n[nH]c1C)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0327 |
| logD: | 1.8984 |
| logSw: | -2.9062 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.335 |
| InChI Key: | OYZCNVOXUXRRDJ-UHFFFAOYSA-N |