N-{6-[(2-chloro-4-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}benzenesulfonamide
Chemical Structure Depiction of
N-{6-[(2-chloro-4-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}benzenesulfonamide
N-{6-[(2-chloro-4-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}benzenesulfonamide
Compound characteristics
| Compound ID: | L366-0586 |
| Compound Name: | N-{6-[(2-chloro-4-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}benzenesulfonamide |
| Molecular Weight: | 472.97 |
| Molecular Formula: | C21 H17 Cl N4 O3 S2 |
| Smiles: | [H]c1cc(cc2c1nc(NS(c1ccccc1)(=O)=O)s2)NC(Nc1ccc(C)cc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7274 |
| logD: | 5.3264 |
| logSw: | -5.9297 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.255 |
| InChI Key: | REHDMSCNSXFOJI-UHFFFAOYSA-N |