3-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazole
3-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | 8008-9864 |
| Compound Name: | 3-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazole |
| Molecular Weight: | 429.49 |
| Molecular Formula: | C25 H17 F2 N3 S |
| Smiles: | C(c1ccc(c2ccccc12)F)Sc1nnc(c2cccc(c2)F)n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.8655 |
| logD: | 6.8655 |
| logSw: | -6.6927 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.4409 |
| InChI Key: | AWYMVEBKPOAUAQ-UHFFFAOYSA-N |