2-{[4-(4-methylphenyl)-1-oxo-5,6,7,8-tetrahydrophthalazin-2(1H)-yl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-{[4-(4-methylphenyl)-1-oxo-5,6,7,8-tetrahydrophthalazin-2(1H)-yl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
2-{[4-(4-methylphenyl)-1-oxo-5,6,7,8-tetrahydrophthalazin-2(1H)-yl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | D262-1016 |
| Compound Name: | 2-{[4-(4-methylphenyl)-1-oxo-5,6,7,8-tetrahydrophthalazin-2(1H)-yl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C24 H22 N4 O2 |
| Smiles: | Cc1ccc(cc1)C1C2CCCCC=2C(N(CC2=CC(N3C=CC=CC3=N2)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4847 |
| logD: | 3.4847 |
| logSw: | -3.4679 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.374 |
| InChI Key: | PMHRBFSSXJAMFC-UHFFFAOYSA-N |