3-(4-tert-butylphenyl)-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(4-tert-butylphenyl)-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
3-(4-tert-butylphenyl)-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | 8012-4511 |
| Compound Name: | 3-(4-tert-butylphenyl)-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole |
| Molecular Weight: | 429.58 |
| Molecular Formula: | C26 H27 N3 O S |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nnc(n1c1ccccc1)SCc1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 6.7674 |
| logD: | 6.7674 |
| logSw: | -5.9652 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.256 |
| InChI Key: | RXTKSKCVVISZMV-UHFFFAOYSA-N |