3-{[([1,1'-biphenyl]-4-yl)methyl]sulfanyl}-5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[([1,1'-biphenyl]-4-yl)methyl]sulfanyl}-5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazole
3-{[([1,1'-biphenyl]-4-yl)methyl]sulfanyl}-5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | 8008-6324 |
| Compound Name: | 3-{[([1,1'-biphenyl]-4-yl)methyl]sulfanyl}-5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 413.58 |
| Molecular Formula: | C26 H27 N3 S |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nnc(n1C)SCc1ccc(cc1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.0526 |
| logD: | 7.0526 |
| logSw: | -6.202 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.7792 |
| InChI Key: | UNZNWYGMBNSWFQ-UHFFFAOYSA-N |