4-[4-(3,4-dimethylphenyl)-5-({[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]pyridine
Chemical Structure Depiction of
4-[4-(3,4-dimethylphenyl)-5-({[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]pyridine
4-[4-(3,4-dimethylphenyl)-5-({[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]pyridine
Compound characteristics
| Compound ID: | D065-0040 |
| Compound Name: | 4-[4-(3,4-dimethylphenyl)-5-({[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]pyridine |
| Molecular Weight: | 446.55 |
| Molecular Formula: | C22 H18 N6 O S2 |
| Smiles: | Cc1ccc(cc1C)n1c(c2ccncc2)nnc1SCc1nc(c2cccs2)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.4505 |
| logD: | 5.4504 |
| logSw: | -5.3102 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.502 |
| InChI Key: | BDKQWRNQNVZSEL-UHFFFAOYSA-N |