N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3,4,5-trimethoxybenzamide
N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | D336-5018 |
| Compound Name: | N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 466.58 |
| Molecular Formula: | C24 H22 N2 O4 S2 |
| Smiles: | COc1cc(cc(c1OC)OC)C(Nc1ccc2c(c1)sc(n2)SCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2449 |
| logD: | 5.2449 |
| logSw: | -5.0559 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.117 |
| InChI Key: | FBTUAJMRLFUEMW-UHFFFAOYSA-N |