3-(3-bromophenyl)-5-{[(4-fluorophenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(3-bromophenyl)-5-{[(4-fluorophenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
3-(3-bromophenyl)-5-{[(4-fluorophenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | 8007-8495 |
| Compound Name: | 3-(3-bromophenyl)-5-{[(4-fluorophenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole |
| Molecular Weight: | 440.34 |
| Molecular Formula: | C21 H15 Br F N3 S |
| Smiles: | C(c1ccc(cc1)F)Sc1nnc(c2cccc(c2)[Br])n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8667 |
| logD: | 5.8667 |
| logSw: | -6.2381 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.7125 |
| InChI Key: | NDFRSOMQWVJFJD-UHFFFAOYSA-N |