4-{[(1'-acetyl-4-oxo-3,4-dihydrospiro[[1]benzopyran-2,4'-piperidin]-7-yl)oxy]acetyl}piperazine-1-carbaldehyde
Chemical Structure Depiction of
4-{[(1'-acetyl-4-oxo-3,4-dihydrospiro[[1]benzopyran-2,4'-piperidin]-7-yl)oxy]acetyl}piperazine-1-carbaldehyde
4-{[(1'-acetyl-4-oxo-3,4-dihydrospiro[[1]benzopyran-2,4'-piperidin]-7-yl)oxy]acetyl}piperazine-1-carbaldehyde
Compound characteristics
| Compound ID: | Y041-4236 |
| Compound Name: | 4-{[(1'-acetyl-4-oxo-3,4-dihydrospiro[[1]benzopyran-2,4'-piperidin]-7-yl)oxy]acetyl}piperazine-1-carbaldehyde |
| Molecular Weight: | 429.47 |
| Molecular Formula: | C22 H27 N3 O6 |
| Smiles: | CC(N1CCC2(CC1)CC(c1ccc(cc1O2)OCC(N1CCN(CC1)C=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.5883 |
| logD: | -0.5883 |
| logSw: | -2.128 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.507 |
| InChI Key: | LJDQEZQKZCPMNU-UHFFFAOYSA-N |