4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid
TL;DR: 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid (CAS 2878-04-8) is a chemical compound with molecular formula C11H11N7O2 and molecular weight 273.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2,4,6-triaminopyrimidin-5-yl)diazenyl]benzoic acid
Also Known As: p-((2,4,6-Triamino-5-pyrimidinyl)azo)benzoic acid, 4-[(2,4,6-triaminopyrimidin-5-yl)diazenyl]benzoic acid, BENZOIC ACID, p-((2,4,6-TRIAMINO-5-PYRIMIDINYL)AZO)-, 5-25-18-00287 (Beilstein Handbook Reference), 4-(2,4,6-triamino-pyrimidin-5-ylazo)-benzoic acid
| Molecular Formula | C11H11N7O2 |
|---|---|
| Molecular Weight | 273.10 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.0974 |
| Heavy Atoms | 20 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 2878-04-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)N=NC2=C(N=C(N=C2N)N)N |
| InChIKey | KJXBXATYKAWGBL-UHFFFAOYSA-N |
Product Overview
4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid (CAS 2878-04-8), with molecular formula C11H11N7O2 and molecular weight 273.10 g/mol. IUPAC: 4-[(2,4,6-triaminopyrimidin-5-yl)diazenyl]benzoic acid.
Chemical Property Profile of 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid
Property Insights of 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid. The TPSA of 166.0 Ų indicates high polarity, suggesting 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid has 4 hydrogen bond donor(s) and 9 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-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid?
The CAS number of 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid is 2878-04-8.
What is the molecular formula of 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid?
The molecular formula of 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid is C11H11N7O2.
What is the molecular weight of 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid?
The molecular weight of 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid is 273.10 g/mol.
Where can I buy 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid?
You can request a quote for 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-(2,4,6-Triaminopyrimidin-5-yl)diazen-1-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.