4-{[4-(3-chlorophenyl)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-(3-chlorophenyl)piperazin-1-yl]acetyl}-9-propoxy-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one
4-{[4-(3-chlorophenyl)piperazin-1-yl]acetyl}-9-propoxy-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one
Compound characteristics
| Compound ID: | C285-0090 |
| Compound Name: | 4-{[4-(3-chlorophenyl)piperazin-1-yl]acetyl}-9-propoxy-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one |
| Molecular Weight: | 496.01 |
| Molecular Formula: | C27 H30 Cl N3 O4 |
| Smiles: | CCCOc1ccc2c(c1)C1CCCN(C=1C(=O)O2)C(CN1CCN(CC1)c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4911 |
| logD: | 4.4895 |
| logSw: | -4.6082 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.862 |
| InChI Key: | HMRMZEMDWQWXFC-UHFFFAOYSA-N |