9-(benzyloxy)-4-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one
Chemical Structure Depiction of
9-(benzyloxy)-4-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one
9-(benzyloxy)-4-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one
Compound characteristics
| Compound ID: | 5682-0166 |
| Compound Name: | 9-(benzyloxy)-4-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one |
| Molecular Weight: | 558.08 |
| Molecular Formula: | C32 H32 Cl N3 O4 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)CC(N1CCCC2=C1C(=O)Oc1ccc(cc12)OCc1ccccc1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.6451 |
| logD: | 5.6422 |
| logSw: | -5.7322 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.37 |
| InChI Key: | RQMRHSBIUBZMMQ-UHFFFAOYSA-N |