3-methyl-N-{2-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-6-yl}butanamide
Chemical Structure Depiction of
3-methyl-N-{2-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-6-yl}butanamide
3-methyl-N-{2-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-6-yl}butanamide
Compound characteristics
| Compound ID: | F260-0036 |
| Compound Name: | 3-methyl-N-{2-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-6-yl}butanamide |
| Molecular Weight: | 403.52 |
| Molecular Formula: | C19 H21 N3 O3 S2 |
| Smiles: | CC(C)CC(Nc1ccc2c(c1)sc(NS(c1ccc(C)cc1)(=O)=O)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7588 |
| logD: | 4.3578 |
| logSw: | -4.4726 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.799 |
| InChI Key: | XUGRIFHFLMILNJ-UHFFFAOYSA-N |