N-{3-[1-(5-chloro-2-methylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,4-dimethylbenzamide
Chemical Structure Depiction of
N-{3-[1-(5-chloro-2-methylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,4-dimethylbenzamide
N-{3-[1-(5-chloro-2-methylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,4-dimethylbenzamide
Compound characteristics
| Compound ID: | G193-0461 |
| Compound Name: | N-{3-[1-(5-chloro-2-methylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,4-dimethylbenzamide |
| Molecular Weight: | 438.94 |
| Molecular Formula: | C21 H19 Cl N6 O S |
| Smiles: | Cc1ccc(cc1C)C(Nc1nc(c2c(C)n(c3cc(ccc3C)[Cl])nn2)ns1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6005 |
| logD: | 5.5827 |
| logSw: | -6.0041 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.459 |
| InChI Key: | JVEWGGUROANGPC-UHFFFAOYSA-N |