3-[5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]-1H-indole
Chemical Structure Depiction of
3-[5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]-1H-indole
3-[5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]-1H-indole
Compound characteristics
| Compound ID: | G878-0029 |
| Compound Name: | 3-[5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]-1H-indole |
| Molecular Weight: | 392.52 |
| Molecular Formula: | C22 H24 N4 O S |
| Smiles: | Cc1ccc(C)c(CSc2nnc(c3c[nH]c4ccccc34)n2CCOC)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.3627 |
| logD: | 5.3627 |
| logSw: | -5.6021 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.432 |
| InChI Key: | WWOMNVWHKWIQIB-UHFFFAOYSA-N |