N-{4-methyl-6-[(4-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}benzenesulfonamide
Chemical Structure Depiction of
N-{4-methyl-6-[(4-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}benzenesulfonamide
N-{4-methyl-6-[(4-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}benzenesulfonamide
Compound characteristics
| Compound ID: | L366-0688 |
| Compound Name: | N-{4-methyl-6-[(4-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}benzenesulfonamide |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C22 H20 N4 O3 S2 |
| Smiles: | Cc1ccc(cc1)NC(Nc1cc(C)c2c(c1)sc(NS(c1ccccc1)(=O)=O)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6728 |
| logD: | 5.0119 |
| logSw: | -5.3975 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 83.723 |
| InChI Key: | GPHAZANOLDTVOE-UHFFFAOYSA-N |