3-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-ethyl-5-(2-phenylethyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-ethyl-5-(2-phenylethyl)-4H-1,2,4-triazole
3-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-ethyl-5-(2-phenylethyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-1139 |
| Compound Name: | 3-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-ethyl-5-(2-phenylethyl)-4H-1,2,4-triazole |
| Molecular Weight: | 375.89 |
| Molecular Formula: | C19 H19 Cl F N3 S |
| Smiles: | CCn1c(CCc2ccccc2)nnc1SCc1ccc(cc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 5.478 |
| logD: | 5.4779 |
| logSw: | -6.0164 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.9417 |
| InChI Key: | RCCDFBAJVOBQQZ-UHFFFAOYSA-N |