3-(4-bromophenyl)-5-({[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(4-bromophenyl)-5-({[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazole
3-(4-bromophenyl)-5-({[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | 6734-1247 |
| Compound Name: | 3-(4-bromophenyl)-5-({[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazole |
| Molecular Weight: | 496.41 |
| Molecular Formula: | C21 H14 Br N5 O S2 |
| Smiles: | C(c1nc(c2ccc(cc2)[Br])no1)Sc1nnc(c2cccs2)n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.369 |
| logD: | 6.3688 |
| logSw: | -6.2651 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.074 |
| InChI Key: | KUHPAWBMKLSGRQ-UHFFFAOYSA-N |