3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazole
3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y207-4208 |
| Compound Name: | 3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazole |
| Molecular Weight: | 379.9 |
| Molecular Formula: | C17 H15 Cl F N3 S2 |
| Smiles: | C=CCn1c(Cc2cccs2)nnc1SCc1c(cccc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 4.6305 |
| logD: | 4.6305 |
| logSw: | -4.9737 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 26.2137 |
| InChI Key: | PBLYUJHIUSPEHM-UHFFFAOYSA-N |