2-[(1H-indol-3-yl)sulfanyl]-1-[5-(4-methoxyphenyl)-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-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-[(1H-indol-3-yl)sulfanyl]-1-[5-(4-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | K413-0510 |
| Compound Name: | 2-[(1H-indol-3-yl)sulfanyl]-1-[5-(4-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C24 H21 N3 O2 S2 |
| Smiles: | [H]n1cc(c2ccccc12)SCC(N1C(CC(c2cccs2)=N1)c1ccc(cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5063 |
| logD: | 5.5063 |
| logSw: | -5.7574 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.02 |
| InChI Key: | YICNHZTYNMGKMR-OAQYLSRUSA-N |