5-({[5-(4-chlorophenyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(thiophen-2-yl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-({[5-(4-chlorophenyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(thiophen-2-yl)-1,2,4-oxadiazole
5-({[5-(4-chlorophenyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(thiophen-2-yl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | D065-0169 |
| Compound Name: | 5-({[5-(4-chlorophenyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(thiophen-2-yl)-1,2,4-oxadiazole |
| Molecular Weight: | 469.95 |
| Molecular Formula: | C21 H13 Cl F N5 O S2 |
| Smiles: | C(c1nc(c2cccs2)no1)Sc1nnc(c2ccc(cc2)[Cl])n1c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 6.2215 |
| logD: | 6.2215 |
| logSw: | -6.5988 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.074 |
| InChI Key: | IGBAZCMWNJZHMW-UHFFFAOYSA-N |