[(1'-acetyl-4-oxo-3,4-dihydrospiro[[1]benzopyran-2,4'-piperidin]-7-yl)oxy]acetic acid
Chemical Structure Depiction of
[(1'-acetyl-4-oxo-3,4-dihydrospiro[[1]benzopyran-2,4'-piperidin]-7-yl)oxy]acetic acid
[(1'-acetyl-4-oxo-3,4-dihydrospiro[[1]benzopyran-2,4'-piperidin]-7-yl)oxy]acetic acid
Compound characteristics
| Compound ID: | Y041-9991 |
| Compound Name: | [(1'-acetyl-4-oxo-3,4-dihydrospiro[[1]benzopyran-2,4'-piperidin]-7-yl)oxy]acetic acid |
| Molecular Weight: | 333.34 |
| Molecular Formula: | C17 H19 N O6 |
| Smiles: | CC(N1CCC2(CC1)CC(c1ccc(cc1O2)OCC(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8592 |
| logD: | -3.3778 |
| logSw: | -2.1749 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.301 |
| InChI Key: | XKRPWUYLQYOWEL-UHFFFAOYSA-N |