5,5'-methylenebis(4-benzyl-4H-1,2,4-triazole-3-thiol)
Chemical Structure Depiction of
5,5'-methylenebis(4-benzyl-4H-1,2,4-triazole-3-thiol)
5,5'-methylenebis(4-benzyl-4H-1,2,4-triazole-3-thiol)
Compound characteristics
| Compound ID: | 8019-9000 |
| Compound Name: | 5,5'-methylenebis(4-benzyl-4H-1,2,4-triazole-3-thiol) |
| Molecular Weight: | 394.52 |
| Molecular Formula: | C19 H18 N6 S2 |
| Smiles: | C(c1nnc(n1Cc1ccccc1)S)c1nnc(n1Cc1ccccc1)S |
| Stereo: | ACHIRAL |
| logP: | 2.5952 |
| logD: | 2.1707 |
| logSw: | -2.6478 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.414 |
| InChI Key: | PKDMQHNYBQEXKL-UHFFFAOYSA-N |