N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2,6-dimethoxybenzamide
Chemical Structure Depiction of
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2,6-dimethoxybenzamide
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2,6-dimethoxybenzamide
Compound characteristics
| Compound ID: | Y030-8725 |
| Compound Name: | N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2,6-dimethoxybenzamide |
| Molecular Weight: | 415.47 |
| Molecular Formula: | C20 H21 N3 O5 S |
| Smiles: | COc1ccc(Cc2nnc(NC(c3c(cccc3OC)OC)=O)s2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.8777 |
| logD: | 0.3025 |
| logSw: | -3.4603 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.62 |
| InChI Key: | POPTVJGRSKQTIV-UHFFFAOYSA-N |