N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3-ethoxypropanamide
Chemical Structure Depiction of
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3-ethoxypropanamide
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3-ethoxypropanamide
Compound characteristics
| Compound ID: | Y031-1371 |
| Compound Name: | N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3-ethoxypropanamide |
| Molecular Weight: | 351.42 |
| Molecular Formula: | C16 H21 N3 O4 S |
| Smiles: | CCOCCC(Nc1nnc(Cc2ccc(c(c2)OC)OC)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1305 |
| logD: | 2.117 |
| logSw: | -2.9962 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.395 |
| InChI Key: | NJSOKCVHIWQHQT-UHFFFAOYSA-N |