N-(2-{[2-(2-methoxy-4-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-methylbenzamide
Chemical Structure Depiction of
N-(2-{[2-(2-methoxy-4-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-methylbenzamide
N-(2-{[2-(2-methoxy-4-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-methylbenzamide
Compound characteristics
| Compound ID: | D336-4623 |
| Compound Name: | N-(2-{[2-(2-methoxy-4-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-methylbenzamide |
| Molecular Weight: | 464.6 |
| Molecular Formula: | C25 H24 N2 O3 S2 |
| Smiles: | Cc1ccc(cc1)C(Nc1ccc2c(c1)sc(n2)SCCOc1ccc(C)cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1112 |
| logD: | 6.1105 |
| logSw: | -5.3893 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.274 |
| InChI Key: | VVGAJYWUZBGPSU-UHFFFAOYSA-N |