1-{3-[2-(azetidin-1-yl)-2-oxoethyl]-3,4-dihydrospiro[[2]benzopyran-1,4'-piperidin]-1'-yl}propan-1-one
Chemical Structure Depiction of
1-{3-[2-(azetidin-1-yl)-2-oxoethyl]-3,4-dihydrospiro[[2]benzopyran-1,4'-piperidin]-1'-yl}propan-1-one
1-{3-[2-(azetidin-1-yl)-2-oxoethyl]-3,4-dihydrospiro[[2]benzopyran-1,4'-piperidin]-1'-yl}propan-1-one
Compound characteristics
| Compound ID: | SA90-0169 |
| Compound Name: | 1-{3-[2-(azetidin-1-yl)-2-oxoethyl]-3,4-dihydrospiro[[2]benzopyran-1,4'-piperidin]-1'-yl}propan-1-one |
| Molecular Weight: | 356.46 |
| Molecular Formula: | C21 H28 N2 O3 |
| Smiles: | CCC(N1CCC2(CC1)c1ccccc1CC(CC(N1CCC1)=O)O2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9409 |
| logD: | 1.9409 |
| logSw: | -2.4664 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.387 |
| InChI Key: | KPCSMSAMBATQFB-QGZVFWFLSA-N |