![2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid structure](/static/products/5287/52872-44-3.webp)
2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid
TL;DR: 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid (CAS 52872-44-3) is a chemical compound with molecular formula C9H11N3O4 and molecular weight 225.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[carboxymethyl(methyl)amino]-4-methylpyrimidine-5-carboxylic acid
Also Known As: 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid, 2-[carboxymethyl(methyl)amino]-4-methylpyrimidine-5-carboxyl, 2-[carboxymethyl(methyl)amino]-4-methylpyrimidine-5-carboxylic acid
| Molecular Formula | C9H11N3O4 |
|---|---|
| Molecular Weight | 225.07 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.07495 |
| Heavy Atoms | 16 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 52872-44-3 |
|---|---|
| SMILES | CC1=NC(=NC=C1C(=O)O)N(C)CC(=O)O |
| InChIKey | QAQSLBRHYUEUND-UHFFFAOYSA-N |
Product Overview
2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid (CAS 52872-44-3), with molecular formula C9H11N3O4 and molecular weight 225.07 g/mol. IUPAC: 2-[carboxymethyl(methyl)amino]-4-methylpyrimidine-5-carboxylic acid.
Chemical Property Profile of 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid
Property Insights of 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid. Following Lipinski's Rule of Five, 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid has 2 hydrogen bond donor(s) and 7 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 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid?
The CAS number of 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid is 52872-44-3.
What is the molecular formula of 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid?
The molecular formula of 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid is C9H11N3O4.
What is the molecular weight of 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid?
The molecular weight of 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid is 225.07 g/mol.
Where can I buy 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid?
You can request a quote for 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Carboxymethyl)(methyl)amino]-4-methylpyrimidine-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.