N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]-4-propylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]-4-propylbenzene-1-sulfonamide
N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]-4-propylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | M071-0385 |
| Compound Name: | N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]-4-propylbenzene-1-sulfonamide |
| Molecular Weight: | 438.59 |
| Molecular Formula: | C19 H22 N2 O4 S3 |
| Smiles: | CCCc1ccc(cc1)S(Nc1ccc2c(c1)sc(n2)S(CCC)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0706 |
| logD: | 4.7408 |
| logSw: | -4.8068 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.42 |
| InChI Key: | ASVPMYUKSNQIEZ-UHFFFAOYSA-N |