TL;DR: 9-methyl-2-(methylamino)-3-[(E)-(phenylimino)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one (CAS 1351442-63-1) is a chemical compound with molecular formula C17H16N4O and molecular weight 292.13242 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9-methyl-2-(methylamino)-3-(phenyliminomethyl)pyrido[1,2-a]pyrimidin-4-one
Also Known As: 9-methyl-2-(methylamino)-3-[(E)-(phenylimino)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one, 3-(anilinomethylidene)-9-methyl-2-methyliminopyrido[1,2-a]pyrimidin-4-one, (3E)-3-(anilinomethylidene)-9-methyl-2-methyliminopyrido[1,2-a]pyrimidin-4-one, (E)-9-methyl-2-(methylamino)-3-((phenylimino)methyl)-4H-pyrido[1,2-a]pyrimidin-4-one
| Molecular Formula | C17H16N4O |
| Molecular Weight | 292.13242 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 57.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.13242 Da |
| Heavy Atoms | 22 |
| Complexity | 619.0 |
| SMILES | CC1=CC=CN2C1=NC(=C(C2=O)C=NC3=CC=CC=C3)NC |
| InChIKey | ZOQXRPZONDVJEF-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-methyl-2-(methylamino)-3-[(E)-(phenylimino)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one. With a topological polar surface area (TPSA) of 57.1 Ų, 9-methyl-2-(methylamino)-3-[(E)-(phenylimino)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-methyl-2-(methylamino)-3-[(E)-(phenylimino)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 9-methyl-2-(methylamino)-3-[(E)-(phenylimino)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one is 1351442-63-1.
The molecular formula of 9-methyl-2-(methylamino)-3-[(E)-(phenylimino)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one is C17H16N4O.
The molecular weight of 9-methyl-2-(methylamino)-3-[(E)-(phenylimino)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one is 292.13242 g/mol.
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