3-chloro-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
3-chloro-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide
3-chloro-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | Y030-8753 |
| Compound Name: | 3-chloro-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 389.86 |
| Molecular Formula: | C18 H16 Cl N3 O3 S |
| Smiles: | COc1ccc(Cc2nnc(NC(c3cccc(c3)[Cl])=O)s2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.0178 |
| logD: | 3.0597 |
| logSw: | -4.433 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.359 |
| InChI Key: | WGBVPTRTAXMOBG-UHFFFAOYSA-N |