5-chloro-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methoxybenzamide
Chemical Structure Depiction of
5-chloro-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methoxybenzamide
5-chloro-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methoxybenzamide
Compound characteristics
| Compound ID: | Y030-8913 |
| Compound Name: | 5-chloro-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methoxybenzamide |
| Molecular Weight: | 419.89 |
| Molecular Formula: | C19 H18 Cl N3 O4 S |
| Smiles: | COc1ccc(cc1C(Nc1nnc(Cc2ccc(c(c2)OC)OC)s1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.0186 |
| logD: | 1.8259 |
| logSw: | -4.5205 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.99 |
| InChI Key: | BBBGVWPCGISFKK-UHFFFAOYSA-N |