![3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one structure](/static/products/5450/54504-66-4.webp)
3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
TL;DR: 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one (CAS 54504-66-4) is a chemical compound with molecular formula C11H10N2O3 and molecular weight 218.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetic acid
Also Known As: 6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-acetic acid, 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one, 6-Methyl-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-aceticacid, 4H-Pyrido[1,2-a]pyrimidine-3-acetic acid, 6-methyl-4-oxo-, 2-(6-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetic acid
| Molecular Formula | C11H10N2O3 |
|---|---|
| Molecular Weight | 218.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 70.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.06914 |
| Heavy Atoms | 16 |
| Complexity | 483.0 |
Chemical Identifiers
| CAS Number | 54504-66-4 |
|---|---|
| SMILES | CC1=CC=CC2=NC=C(C(=O)N12)CC(=O)O |
| InChIKey | XIXNFCBRYVASGT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one (CAS 54504-66-4), with molecular formula C11H10N2O3 and molecular weight 218.07 g/mol. IUPAC: 2-(6-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetic acid.
Chemical Property Profile of 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Property Insights of 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one. Following Lipinski's Rule of Five, 3-Carboxymethyl-6-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.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one?
The CAS number of 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one is 54504-66-4.
What is the molecular formula of 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one?
The molecular formula of 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one is C11H10N2O3.
What is the molecular weight of 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one?
The molecular weight of 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one is 218.07 g/mol.
Where can I buy 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one?
You can request a quote for 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Carboxymethyl-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.