3-{5-[(butan-2-yl)sulfanyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}-1H-indole
Chemical Structure Depiction of
3-{5-[(butan-2-yl)sulfanyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}-1H-indole
3-{5-[(butan-2-yl)sulfanyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}-1H-indole
Compound characteristics
| Compound ID: | G878-0084 |
| Compound Name: | 3-{5-[(butan-2-yl)sulfanyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}-1H-indole |
| Molecular Weight: | 378.49 |
| Molecular Formula: | C21 H22 N4 O S |
| Smiles: | CCC(C)Sc1nnc(c2c[nH]c3ccccc23)n1c1ccc(cc1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2577 |
| logD: | 5.2577 |
| logSw: | -5.4006 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.399 |
| InChI Key: | FQXQJXQUPLLOAS-AWEZNQCLSA-N |