2-[(1H-indol-3-yl)sulfanyl]-1-[5-(4-methylphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[(1H-indol-3-yl)sulfanyl]-1-[5-(4-methylphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-[(1H-indol-3-yl)sulfanyl]-1-[5-(4-methylphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | K413-0508 |
| Compound Name: | 2-[(1H-indol-3-yl)sulfanyl]-1-[5-(4-methylphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 431.58 |
| Molecular Formula: | C24 H21 N3 O S2 |
| Smiles: | [H]n1cc(c2ccccc12)SCC(N1C(CC(c2cccs2)=N1)c1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9473 |
| logD: | 5.9473 |
| logSw: | -5.7391 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.476 |
| InChI Key: | GIDFCHSJFUTQEK-OAQYLSRUSA-N |