3-(2-methyl-1,3-benzothiazole-6-sulfonyl)-N-(3-methylphenyl)propanamide
Chemical Structure Depiction of
3-(2-methyl-1,3-benzothiazole-6-sulfonyl)-N-(3-methylphenyl)propanamide
3-(2-methyl-1,3-benzothiazole-6-sulfonyl)-N-(3-methylphenyl)propanamide
Compound characteristics
| Compound ID: | E557-3328 |
| Compound Name: | 3-(2-methyl-1,3-benzothiazole-6-sulfonyl)-N-(3-methylphenyl)propanamide |
| Molecular Weight: | 374.48 |
| Molecular Formula: | C18 H18 N2 O3 S2 |
| Smiles: | Cc1cccc(c1)NC(CCS(c1ccc2c(c1)sc(C)n2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1678 |
| logD: | 3.1677 |
| logSw: | -3.3744 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.679 |
| InChI Key: | UVMOMRIBVBVFIU-UHFFFAOYSA-N |