4-chloro-N-{3-[1-(2,6-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-(2,6-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}benzamide
4-chloro-N-{3-[1-(2,6-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}benzamide
Compound characteristics
| Compound ID: | C200-4601 |
| Compound Name: | 4-chloro-N-{3-[1-(2,6-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: | Cc1cccc(C)c1n1c(C)c(c2nc(NC(c3ccc(cc3)[Cl])=O)sn2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.8357 |
| logD: | 4.8008 |
| logSw: | -4.9529 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.158 |
| InChI Key: | OLLWDZGSTKZVKV-UHFFFAOYSA-N |