4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride
TL;DR: 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride (CAS 89450-93-1) is a chemical compound with molecular formula C19H15ClN4O6 and molecular weight 430.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-bis(2-carboxyanilino)pyrimidine-4-carboxylic acid;hydrochloride
Also Known As: 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride, 2,6-Bis(o-carboxyanilino)-4-pyrimidinecarboxylic acid hydrochloride, 4-Pyrimidinecarboxylic acid, 2,6-bis((2-carboxyphenyl)amino)-, monohydrochloride, 2,6-bis(2-carboxyanilino)pyrimidine-4-carboxylic acid hydrochloride, 2,6-Bis(2-carboxyanilino)pyrimidine-4-carboxylic acid--hydrogen chloride (1/1)
| Molecular Formula | C19H15ClN4O6 |
|---|---|
| Molecular Weight | 430.07 g/mol |
| LogP | 3.4802 |
| Topological Polar Surface Area | 161.74 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 430.06802 |
| Heavy Atoms | 30 |
| Complexity | 1043.9337 |
Chemical Identifiers
| CAS Number | 89450-93-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)NC2=NC(=NC(=C2)C(=O)O)NC3=CC=CC=C3C(=O)O.Cl |
Product Overview
4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride (CAS 89450-93-1), with molecular formula C19H15ClN4O6 and molecular weight 430.07 g/mol. IUPAC: 2,6-bis(2-carboxyanilino)pyrimidine-4-carboxylic acid;hydrochloride.
Chemical Property Profile of 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride
Property Insights of 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride
The XLogP value of 3.4802 indicates that 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 161.74 Ų indicates high polarity, suggesting 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride has 5 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 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride?
The CAS number of 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride is 89450-93-1.
What is the molecular formula of 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride?
The molecular formula of 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride is C19H15ClN4O6.
What is the molecular weight of 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride?
The molecular weight of 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride is 430.07 g/mol.
Where can I buy 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride?
You can request a quote for 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyrimidinecarboxylic acid, 2,6-bis(o-carboxyanilino)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.