3-(3-oxo-1,3-dihydro-2H-indol-2-ylidene)pentane-2,4-dione
Chemical Structure Depiction of
3-(3-oxo-1,3-dihydro-2H-indol-2-ylidene)pentane-2,4-dione
3-(3-oxo-1,3-dihydro-2H-indol-2-ylidene)pentane-2,4-dione
Compound characteristics
| Compound ID: | 4400-0027 |
| Compound Name: | 3-(3-oxo-1,3-dihydro-2H-indol-2-ylidene)pentane-2,4-dione |
| Molecular Weight: | 229.23 |
| Molecular Formula: | C13 H11 N O3 |
| Smiles: | CC(C(=C1C(c2ccccc2N1)=O)C(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5105 |
| logD: | 1.5027 |
| logSw: | -2.2609 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.004 |
| InChI Key: | PNPGREBKOFIGDR-UHFFFAOYSA-N |