N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3,4,5-trimethoxybenzamide
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | Y030-8859 |
| Compound Name: | N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 445.49 |
| Molecular Formula: | C21 H23 N3 O6 S |
| Smiles: | COc1ccc(Cc2nnc(NC(c3cc(c(c(c3)OC)OC)OC)=O)s2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.1358 |
| logD: | 3.1226 |
| logSw: | -3.4529 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.337 |
| InChI Key: | RVLXFEVFKJTWKN-UHFFFAOYSA-N |