3-(4-fluorophenyl)-5-{[(3-fluorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(4-fluorophenyl)-5-{[(3-fluorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
3-(4-fluorophenyl)-5-{[(3-fluorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V006-1836 |
| Compound Name: | 3-(4-fluorophenyl)-5-{[(3-fluorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 343.4 |
| Molecular Formula: | C18 H15 F2 N3 S |
| Salt: | not_available |
| Smiles: | C=CCn1c(c2ccc(cc2)F)nnc1SCc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 4.7945 |
| logD: | 4.7945 |
| logSw: | -4.9849 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.2191 |
| InChI Key: | XLGQRKHUDZAQBB-UHFFFAOYSA-N |