2-{[5-(4-fluorophenyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethan-1-one
Chemical Structure Depiction of
2-{[5-(4-fluorophenyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethan-1-one
2-{[5-(4-fluorophenyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethan-1-one
Compound characteristics
| Compound ID: | G865-0023 |
| Compound Name: | 2-{[5-(4-fluorophenyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethan-1-one |
| Molecular Weight: | 403.48 |
| Molecular Formula: | C23 H18 F N3 O S |
| Smiles: | Cc1ccccc1n1c(c2ccc(cc2)F)nnc1SCC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1978 |
| logD: | 5.1978 |
| logSw: | -5.0977 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.659 |
| InChI Key: | ITAXUHFMNHUGHD-UHFFFAOYSA-N |