5-({[4-(2-methylpropyl)-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(thiophen-2-yl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-({[4-(2-methylpropyl)-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(thiophen-2-yl)-1,2,4-oxadiazole
5-({[4-(2-methylpropyl)-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(thiophen-2-yl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | D065-0134 |
| Compound Name: | 5-({[4-(2-methylpropyl)-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(thiophen-2-yl)-1,2,4-oxadiazole |
| Molecular Weight: | 425.57 |
| Molecular Formula: | C21 H23 N5 O S2 |
| Smiles: | CC(C)Cn1c(CCc2ccccc2)nnc1SCc1nc(c2cccs2)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.6793 |
| logD: | 5.6792 |
| logSw: | -5.5937 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.578 |
| InChI Key: | CAHYYCCXWOWMCU-UHFFFAOYSA-N |