3-(5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-1H-indole
Chemical Structure Depiction of
3-(5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-1H-indole
3-(5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-1H-indole
Compound characteristics
| Compound ID: | G856-2687 |
| Compound Name: | 3-(5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-1H-indole |
| Molecular Weight: | 348.47 |
| Molecular Formula: | C20 H20 N4 S |
| Smiles: | Cc1ccc(C)c(CSc2nnc(c3c[nH]c4ccccc34)n2C)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.1749 |
| logD: | 5.1749 |
| logSw: | -5.2093 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.922 |
| InChI Key: | ZSNOFZNDQDYJPI-UHFFFAOYSA-N |