5-oxo-4-[(4-phenylpiperazin-1-yl)acetyl]-1,3,4,5-tetrahydro-2H-[1]benzopyrano[3,4-b]pyridin-9-yl acetate
Chemical Structure Depiction of
5-oxo-4-[(4-phenylpiperazin-1-yl)acetyl]-1,3,4,5-tetrahydro-2H-[1]benzopyrano[3,4-b]pyridin-9-yl acetate
5-oxo-4-[(4-phenylpiperazin-1-yl)acetyl]-1,3,4,5-tetrahydro-2H-[1]benzopyrano[3,4-b]pyridin-9-yl acetate
Compound characteristics
| Compound ID: | 8015-7524 |
| Compound Name: | 5-oxo-4-[(4-phenylpiperazin-1-yl)acetyl]-1,3,4,5-tetrahydro-2H-[1]benzopyrano[3,4-b]pyridin-9-yl acetate |
| Molecular Weight: | 461.52 |
| Molecular Formula: | C26 H27 N3 O5 |
| Smiles: | CC(=O)Oc1ccc2c(c1)C1CCCN(C=1C(=O)O2)C(CN1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3414 |
| logD: | 2.3397 |
| logSw: | -3.1578 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.195 |
| InChI Key: | DUJUJTKXCOLQDC-UHFFFAOYSA-N |