N-{3-[1-(2,5-dimethylphenyl)-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-(2,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,5-dimethoxybenzamide
N-{3-[1-(2,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | G193-0312 |
| Compound Name: | N-{3-[1-(2,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,5-dimethoxybenzamide |
| Molecular Weight: | 450.52 |
| Molecular Formula: | C22 H22 N6 O3 S |
| Smiles: | Cc1ccc(C)c(c1)n1c(C)c(c2nc(NC(c3cc(cc(c3)OC)OC)=O)sn2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.7553 |
| logD: | 4.7551 |
| logSw: | -4.5467 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.547 |
| InChI Key: | PDNODGJGFOERCD-UHFFFAOYSA-N |