4-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}-9-propoxy-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one
Chemical Structure Depiction of
4-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}-9-propoxy-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one
4-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}-9-propoxy-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one
Compound characteristics
| Compound ID: | C285-0083 |
| Compound Name: | 4-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}-9-propoxy-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one |
| Molecular Weight: | 510.03 |
| Molecular Formula: | C28 H32 Cl N3 O4 |
| Smiles: | CCCOc1ccc2c(c1)C1CCCN(C=1C(=O)O2)C(CN1CCN(CC1)c1cc(ccc1C)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1901 |
| logD: | 5.1873 |
| logSw: | -5.3784 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.561 |
| InChI Key: | QOEURHBKKZDZPG-UHFFFAOYSA-N |