4-tert-butyl-N-{3-[1-(2-methoxy-5-methylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{3-[1-(2-methoxy-5-methylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}benzamide
4-tert-butyl-N-{3-[1-(2-methoxy-5-methylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}benzamide
Compound characteristics
| Compound ID: | C200-4846 |
| Compound Name: | 4-tert-butyl-N-{3-[1-(2-methoxy-5-methylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}benzamide |
| Molecular Weight: | 462.57 |
| Molecular Formula: | C24 H26 N6 O2 S |
| Smiles: | Cc1ccc(c(c1)n1c(C)c(c2nc(NC(c3ccc(cc3)C(C)(C)C)=O)sn2)nn1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.5857 |
| logD: | 5.5805 |
| logSw: | -5.4117 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.09 |
| InChI Key: | UPQYJLFJTZHJBV-UHFFFAOYSA-N |