Pyrimethamine pamoate
TL;DR: Pyrimethamine pamoate (CAS 96283-37-3) is a chemical compound with molecular formula C47H42Cl2N8O6 and molecular weight 884.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;bis(5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine)
Also Known As: Pyrimethamine pamoate, 2,4-Pyridinediamine, 5-(4-chlorophenyl)-6-ethyl-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (2:1), 4,4'-Methylenebis(3-hydroxynaphthalene-2-carboxylic acid)--5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine (1/2), 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid; 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine
| Molecular Formula | C47H42Cl2N8O6 |
|---|---|
| Molecular Weight | 884.26 g/mol |
| LogP | 9.439 |
| Topological Polar Surface Area | 271.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 8 |
| Exact Mass | 884.26044 |
| Heavy Atoms | 63 |
| Complexity | 811.0 |
Chemical Identifiers
| CAS Number | 96283-37-3 |
|---|---|
| SMILES | CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl.CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl.C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)O)O)C(=O)O |
| InChIKey | AHQFCKBGYCLUEM-UHFFFAOYSA-N |
Product Overview
Pyrimethamine pamoate (CAS 96283-37-3), with molecular formula C47H42Cl2N8O6 and molecular weight 884.26 g/mol. IUPAC: 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;bis(5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine).
Chemical Property Profile of Pyrimethamine pamoate
Property Insights of Pyrimethamine pamoate
The XLogP value of 9.439 indicates that Pyrimethamine pamoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 271.0 Ų indicates high polarity, suggesting Pyrimethamine pamoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pyrimethamine pamoate has 8 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyrimethamine pamoate?
The CAS number of Pyrimethamine pamoate is 96283-37-3.
What is the molecular formula of Pyrimethamine pamoate?
The molecular formula of Pyrimethamine pamoate is C47H42Cl2N8O6.
What is the molecular weight of Pyrimethamine pamoate?
The molecular weight of Pyrimethamine pamoate is 884.26 g/mol.
Where can I buy Pyrimethamine pamoate?
You can request a quote for Pyrimethamine pamoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrimethamine pamoate?
Yes, KEHONG BIO provides custom synthesis services for Pyrimethamine pamoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.