3-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-ethyl-5-(4-fluorophenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-ethyl-5-(4-fluorophenyl)-4H-1,2,4-triazole
3-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-ethyl-5-(4-fluorophenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y206-7217 |
| Compound Name: | 3-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-ethyl-5-(4-fluorophenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 382.28 |
| Molecular Formula: | C17 H14 Cl2 F N3 S |
| Smiles: | CCn1c(c2ccc(cc2)F)nnc1SCc1c(cccc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.7429 |
| logD: | 5.7429 |
| logSw: | -6.1955 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 23.9655 |
| InChI Key: | XMRWNIFTHJYKEU-UHFFFAOYSA-N |