4-[5-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]pyridine
Chemical Structure Depiction of
4-[5-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]pyridine
4-[5-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]pyridine
Compound characteristics
| Compound ID: | D065-0049 |
| Compound Name: | 4-[5-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]pyridine |
| Molecular Weight: | 406.51 |
| Molecular Formula: | C21 H22 N6 O S |
| Smiles: | CC(C)Cn1c(c2ccncc2)nnc1SCc1nc(c2ccc(C)cc2)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.0453 |
| logD: | 5.044 |
| logSw: | -4.4549 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.012 |
| InChI Key: | WLTDZJNUXJRZJU-UHFFFAOYSA-N |