N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(phenylmethanesulfonyl)propanamide
Chemical Structure Depiction of
N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(phenylmethanesulfonyl)propanamide
N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(phenylmethanesulfonyl)propanamide
Compound characteristics
| Compound ID: | Y031-1291 |
| Compound Name: | N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(phenylmethanesulfonyl)propanamide |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C19 H20 N2 O4 S2 |
| Smiles: | CCOc1ccc2c(c1)sc(NC(CCS(Cc1ccccc1)(=O)=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.0661 |
| logD: | 3.0659 |
| logSw: | -3.5257 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.301 |
| InChI Key: | ZBBJENCRPKAHBN-UHFFFAOYSA-N |