3-{5-[(butan-2-yl)sulfanyl]-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl}-1H-indole
Chemical Structure Depiction of
3-{5-[(butan-2-yl)sulfanyl]-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl}-1H-indole
3-{5-[(butan-2-yl)sulfanyl]-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl}-1H-indole
Compound characteristics
| Compound ID: | G856-2711 |
| Compound Name: | 3-{5-[(butan-2-yl)sulfanyl]-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl}-1H-indole |
| Molecular Weight: | 330.45 |
| Molecular Formula: | C17 H22 N4 O S |
| Smiles: | CCC(C)Sc1nnc(c2c[nH]c3ccccc23)n1CCOC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8904 |
| logD: | 3.8904 |
| logSw: | -3.9586 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.704 |
| InChI Key: | IAQNFZTWPYOYGZ-LBPRGKRZSA-N |