N-(5-{2-[(2,5-dichlorophenyl)sulfanyl]ethyl}-1,3,4-thiadiazol-2-yl)-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-(5-{2-[(2,5-dichlorophenyl)sulfanyl]ethyl}-1,3,4-thiadiazol-2-yl)-3,4-dimethoxybenzamide
N-(5-{2-[(2,5-dichlorophenyl)sulfanyl]ethyl}-1,3,4-thiadiazol-2-yl)-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | 3180-0074 |
| Compound Name: | N-(5-{2-[(2,5-dichlorophenyl)sulfanyl]ethyl}-1,3,4-thiadiazol-2-yl)-3,4-dimethoxybenzamide |
| Molecular Weight: | 470.39 |
| Molecular Formula: | C19 H17 Cl2 N3 O3 S2 |
| Smiles: | COc1ccc(cc1OC)C(Nc1nnc(CCSc2cc(ccc2[Cl])[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9221 |
| logD: | 4.7318 |
| logSw: | -4.9981 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.359 |
| InChI Key: | YTAGTQPAYBPDPG-UHFFFAOYSA-N |