2-[(1-methyl-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-methyl-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-methyl-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: | K413-0176 |
| Compound Name: | 2-[(1-methyl-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: | 445.6 |
| Molecular Formula: | C25 H23 N3 O S2 |
| Smiles: | Cc1ccc(cc1)C1CC(c2cccs2)=NN1C(CSc1cn(C)c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7854 |
| logD: | 5.7854 |
| logSw: | -5.5936 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.1651 |
| InChI Key: | FXMCJQJOWVGJPW-JOCHJYFZSA-N |