N-(4-methyl-1,3-benzothiazol-2-yl)-3-(phenylmethanesulfonyl)propanamide
Chemical Structure Depiction of
N-(4-methyl-1,3-benzothiazol-2-yl)-3-(phenylmethanesulfonyl)propanamide
N-(4-methyl-1,3-benzothiazol-2-yl)-3-(phenylmethanesulfonyl)propanamide
Compound characteristics
| Compound ID: | Y031-1297 |
| Compound Name: | N-(4-methyl-1,3-benzothiazol-2-yl)-3-(phenylmethanesulfonyl)propanamide |
| Molecular Weight: | 374.48 |
| Molecular Formula: | C18 H18 N2 O3 S2 |
| Smiles: | Cc1cccc2c1nc(NC(CCS(Cc1ccccc1)(=O)=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.9663 |
| logD: | 2.9655 |
| logSw: | -3.3799 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.948 |
| InChI Key: | WAAJUBYPGOYOKN-UHFFFAOYSA-N |