1-[(5-{[(2-chlorophenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)methyl]-1H-tetrazol-5-amine
Chemical Structure Depiction of
1-[(5-{[(2-chlorophenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)methyl]-1H-tetrazol-5-amine
1-[(5-{[(2-chlorophenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)methyl]-1H-tetrazol-5-amine
Compound characteristics
| Compound ID: | 8018-9549 |
| Compound Name: | 1-[(5-{[(2-chlorophenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)methyl]-1H-tetrazol-5-amine |
| Molecular Weight: | 398.87 |
| Molecular Formula: | C17 H15 Cl N8 S |
| Smiles: | C(c1nnc(n1c1ccccc1)SCc1ccccc1[Cl])n1c(N)nnn1 |
| Stereo: | ACHIRAL |
| logP: | 2.1873 |
| logD: | 2.1862 |
| logSw: | -2.7167 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.926 |
| InChI Key: | LFAGFKDVZNRPGG-UHFFFAOYSA-N |