4-benzyl-5-[2-(4-methylphenyl)cyclopropyl]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-benzyl-5-[2-(4-methylphenyl)cyclopropyl]-4H-1,2,4-triazole-3-thiol
4-benzyl-5-[2-(4-methylphenyl)cyclopropyl]-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y501-7975 |
| Compound Name: | 4-benzyl-5-[2-(4-methylphenyl)cyclopropyl]-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 321.44 |
| Molecular Formula: | C19 H19 N3 S |
| Smiles: | Cc1ccc(cc1)C1CC1c1nnc(n1Cc1ccccc1)S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4088 |
| logD: | 3.6006 |
| logSw: | -4.3355 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.966 |
| InChI Key: | BAFJXKRILKTZMP-UHFFFAOYSA-N |