3-{[(4-bromophenyl)methyl]sulfanyl}-5-(3,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(4-bromophenyl)methyl]sulfanyl}-5-(3,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazole
3-{[(4-bromophenyl)methyl]sulfanyl}-5-(3,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y206-7265 |
| Compound Name: | 3-{[(4-bromophenyl)methyl]sulfanyl}-5-(3,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazole |
| Molecular Weight: | 443.19 |
| Molecular Formula: | C17 H14 Br Cl2 N3 S |
| Smiles: | CCn1c(c2ccc(c(c2)[Cl])[Cl])nnc1SCc1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.2701 |
| logD: | 6.2701 |
| logSw: | -6.4854 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 23.9655 |
| InChI Key: | CCSWPYFZQZHIOD-UHFFFAOYSA-N |