N-[5-(propylcarbamamido)-1,3-benzothiazol-2-yl]benzenesulfonamide
Chemical Structure Depiction of
N-[5-(propylcarbamamido)-1,3-benzothiazol-2-yl]benzenesulfonamide
N-[5-(propylcarbamamido)-1,3-benzothiazol-2-yl]benzenesulfonamide
Compound characteristics
| Compound ID: | M004-0242 |
| Compound Name: | N-[5-(propylcarbamamido)-1,3-benzothiazol-2-yl]benzenesulfonamide |
| Molecular Weight: | 390.48 |
| Molecular Formula: | C17 H18 N4 O3 S2 |
| Smiles: | [H]c1cc2c(cc1NC(NCCC)=O)nc(NS(c1ccccc1)(=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.7529 |
| logD: | 3.3519 |
| logSw: | -3.8805 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.387 |
| InChI Key: | KRMIJSVXIVDXSX-UHFFFAOYSA-N |