4-{3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-2-oxo-2,3-dihydro-1H-indol-1-yl}butanenitrile
Chemical Structure Depiction of
4-{3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-2-oxo-2,3-dihydro-1H-indol-1-yl}butanenitrile
4-{3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-2-oxo-2,3-dihydro-1H-indol-1-yl}butanenitrile
Compound characteristics
| Compound ID: | 5056-0027 |
| Compound Name: | 4-{3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-2-oxo-2,3-dihydro-1H-indol-1-yl}butanenitrile |
| Molecular Weight: | 348.4 |
| Molecular Formula: | C21 H20 N2 O3 |
| Smiles: | Cc1ccc(cc1)C(CC1(C(N(CCCC#N)c2ccccc12)=O)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5319 |
| logD: | 1.5319 |
| logSw: | -2.173 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.785 |
| InChI Key: | CCDRWGDFJKWCPL-NRFANRHFSA-N |