4-chloro-N-{3-[1-(2,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}benzamide
Chemical Structure Depiction of
4-chloro-N-{3-[1-(2,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}benzamide
4-chloro-N-{3-[1-(2,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}benzamide
Compound characteristics
| Compound ID: | G193-0072 |
| Compound Name: | 4-chloro-N-{3-[1-(2,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}benzamide |
| Molecular Weight: | 424.91 |
| Molecular Formula: | C20 H17 Cl N6 O S |
| Smiles: | Cc1ccc(C)c(c1)n1c(C)c(c2nc(NC(c3ccc(cc3)[Cl])=O)sn2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 5.0846 |
| logD: | 5.0498 |
| logSw: | -5.4302 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.459 |
| InChI Key: | LNJJBVGWTYUITN-UHFFFAOYSA-N |