3-{[(3-bromophenyl)methyl]sulfanyl}-5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(3-bromophenyl)methyl]sulfanyl}-5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazole
3-{[(3-bromophenyl)methyl]sulfanyl}-5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y206-7206 |
| Compound Name: | 3-{[(3-bromophenyl)methyl]sulfanyl}-5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazole |
| Molecular Weight: | 408.75 |
| Molecular Formula: | C17 H15 Br Cl N3 S |
| Smiles: | CCn1c(c2ccc(cc2)[Cl])nnc1SCc1cccc(c1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.7372 |
| logD: | 5.7372 |
| logSw: | -6.1675 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 23.9655 |
| InChI Key: | HOKAODJMPVEVJW-UHFFFAOYSA-N |