N-{3-[1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,5-dimethoxybenzamide
Chemical Structure Depiction of
N-{3-[1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,5-dimethoxybenzamide
N-{3-[1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | G193-0295 |
| Compound Name: | N-{3-[1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,5-dimethoxybenzamide |
| Molecular Weight: | 456.91 |
| Molecular Formula: | C20 H17 Cl N6 O3 S |
| Smiles: | Cc1c(c2nc(NC(c3cc(cc(c3)OC)OC)=O)sn2)nnn1c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.3914 |
| logD: | 4.3912 |
| logSw: | -4.7002 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.848 |
| InChI Key: | IONJXYGCBBNFCJ-UHFFFAOYSA-N |