N-(4-bromophenyl)-2-{[4-(2-phenylethyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-{[4-(2-phenylethyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(4-bromophenyl)-2-{[4-(2-phenylethyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y600-0273 |
| Compound Name: | N-(4-bromophenyl)-2-{[4-(2-phenylethyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 499.45 |
| Molecular Formula: | C22 H19 Br N4 O S2 |
| Smiles: | C(Cn1c(c2cccs2)nnc1SCC(Nc1ccc(cc1)[Br])=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6972 |
| logD: | 5.6971 |
| logSw: | -5.7623 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.115 |
| InChI Key: | VYNLFHLVDVAJSX-UHFFFAOYSA-N |