N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-4-ethoxybenzamide
Chemical Structure Depiction of
N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-4-ethoxybenzamide
N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-4-ethoxybenzamide
Compound characteristics
| Compound ID: | D336-5027 |
| Compound Name: | N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-4-ethoxybenzamide |
| Molecular Weight: | 420.55 |
| Molecular Formula: | C23 H20 N2 O2 S2 |
| Smiles: | CCOc1ccc(cc1)C(Nc1ccc2c(c1)sc(n2)SCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8331 |
| logD: | 5.8328 |
| logSw: | -5.4764 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.263 |
| InChI Key: | ROABIVHAPCJIGI-UHFFFAOYSA-N |