4-[5-({[3-(4-chlorophenyl)-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-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]pyridine
4-[5-({[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]pyridine
Compound characteristics
| Compound ID: | D065-0050 |
| Compound Name: | 4-[5-({[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]pyridine |
| Molecular Weight: | 426.93 |
| Molecular Formula: | C20 H19 Cl N6 O S |
| Smiles: | CC(C)Cn1c(c2ccncc2)nnc1SCc1nc(c2ccc(cc2)[Cl])no1 |
| Stereo: | ACHIRAL |
| logP: | 5.2167 |
| logD: | 5.2153 |
| logSw: | -5.9387 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.012 |
| InChI Key: | GDFYBMILWJJZIQ-UHFFFAOYSA-N |