4-tert-butyl-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide
4-tert-butyl-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | 8008-7395 |
| Compound Name: | 4-tert-butyl-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C22 H25 N3 O3 S |
| Smiles: | CC(C)(C)c1ccc(cc1)C(Nc1nnc(Cc2ccc(c(c2)OC)OC)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1495 |
| logD: | 4.7904 |
| logSw: | -5.0771 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.359 |
| InChI Key: | MCZOBRJUNJMXRK-UHFFFAOYSA-N |