TL;DR: 4H-Pyrido(1,2-a)pyrimidine-3-propanoic acid, 9-((4-acetyl-3-hydroxy-2-propylphenoxy)methyl)-4-oxo- (CAS 112668-65-2) is a chemical compound with molecular formula C23H24N2O6 and molecular weight 424.16342 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[9-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-4-oxopyrido[1,2-a]pyrimidin-3-yl]propanoic acid
Also Known As: 4H-Pyrido(1,2-a)pyrimidine-3-propanoic acid, 9-((4-acetyl-3-hydroxy-2-propylphenoxy)methyl)-4-oxo-, 3-(9-((4-Acetyl-3-hydroxy-2-propylphenoxy)methyl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)propanoic acid, 3-[9-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-4-oxopyrido[1,2-a]pyrimidin-3-yl]propanoic acid, 4H-Pyrido[1,2-a]pyrimidine-3-propanoicacid, 9-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-4-oxo-, 3-[9-(4-acetyl-3-hydroxy-2-n-propylphenoxymethyl)-4-oxo-pyrido[1,2-a]pyrimidin-3yl]propionic acid
| Molecular Formula | C23H24N2O6 |
| Molecular Weight | 424.16342 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 117.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 424.16342 Da |
| Heavy Atoms | 31 |
| Complexity | 856.0 |
| SMILES | CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CN3C2=NC=C(C3=O)CCC(=O)O |
| InChIKey | NMGAUISTCJYFBC-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-Pyrido(1,2-a)pyrimidine-3-propanoic acid, 9-((4-acetyl-3-hydroxy-2-propylphenoxy)methyl)-4-oxo-. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4H-Pyrido(1,2-a)pyrimidine-3-propanoic acid, 9-((4-acetyl-3-hydroxy-2-propylphenoxy)methyl)-4-oxo-. Following Lipinski's Rule of Five, 4H-Pyrido(1,2-a)pyrimidine-3-propanoic acid, 9-((4-acetyl-3-hydroxy-2-propylphenoxy)methyl)-4-oxo- has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4H-Pyrido(1,2-a)pyrimidine-3-propanoic acid, 9-((4-acetyl-3-hydroxy-2-propylphenoxy)methyl)-4-oxo- is 112668-65-2.
The molecular formula of 4H-Pyrido(1,2-a)pyrimidine-3-propanoic acid, 9-((4-acetyl-3-hydroxy-2-propylphenoxy)methyl)-4-oxo- is C23H24N2O6.
The molecular weight of 4H-Pyrido(1,2-a)pyrimidine-3-propanoic acid, 9-((4-acetyl-3-hydroxy-2-propylphenoxy)methyl)-4-oxo- is 424.16342 g/mol.
You can request a quote for 4H-Pyrido(1,2-a)pyrimidine-3-propanoic acid, 9-((4-acetyl-3-hydroxy-2-propylphenoxy)methyl)-4-oxo- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Yes, CoreyChem provides custom synthesis services for 4H-Pyrido(1,2-a)pyrimidine-3-propanoic acid, 9-((4-acetyl-3-hydroxy-2-propylphenoxy)methyl)-4-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
Request a quote for CAS 112668-65-2. Our professional technical team will respond with pricing and lead time.