2-[(1-ethyl-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-[(1-ethyl-1H-indol-3-yl)sulfanyl]-1-[5-(4-methylphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-[(1-ethyl-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: | K413-0342 |
| Compound Name: | 2-[(1-ethyl-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: | 459.63 |
| Molecular Formula: | C26 H25 N3 O S2 |
| Smiles: | CCn1cc(c2ccccc12)SCC(N1C(CC(c2cccs2)=N1)c1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0609 |
| logD: | 6.0609 |
| logSw: | -5.5824 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.334 |
| InChI Key: | CWIHWAONTGTRFK-HSZRJFAPSA-N |