p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid
TL;DR: p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid (CAS 99864-84-3) is a chemical compound with molecular formula C11H12N6O3S and molecular weight 308.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2,4-diamino-6-methylpyrimidin-5-yl)diazenyl]benzenesulfonic acid
Also Known As: 4-25-00-04667 (Beilstein Handbook Reference), p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid, Benzenesulfonic acid, p-((2,4-diamino-6-methyl-5-pyrimidinyl)azo)-, p-[(2,4-Diamino-6-methyl-5-pyrimidinyl)azo]benzenesulfonic acid, 4-[(2,4-diamino-6-methylpyrimidin-5-yl)diazenyl]benzenesulfonic acid
| Molecular Formula | C11H12N6O3S |
|---|---|
| Molecular Weight | 308.07 g/mol |
| LogP | 1.61152 |
| Topological Polar Surface Area | 156.91 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.06915 |
| Heavy Atoms | 21 |
| Complexity | 778.2034 |
Chemical Identifiers
| CAS Number | 99864-84-3 |
|---|---|
| SMILES | CC1=C(C(=NC(=N1)N)N)N=NC2=CC=C(C=C2)S(=O)(=O)O |
Product Overview
p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid (CAS 99864-84-3), with molecular formula C11H12N6O3S and molecular weight 308.07 g/mol. IUPAC: 4-[(2,4-diamino-6-methylpyrimidin-5-yl)diazenyl]benzenesulfonic acid.
Chemical Property Profile of p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid
Property Insights of p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid
The XLogP value of 1.61152 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid. The TPSA of 156.91 Ų indicates high polarity, suggesting p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid has 3 hydrogen bond donor(s) and 8 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 p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid?
The CAS number of p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid is 99864-84-3.
What is the molecular formula of p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid?
The molecular formula of p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid is C11H12N6O3S.
What is the molecular weight of p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid?
The molecular weight of p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid is 308.07 g/mol.
Where can I buy p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid?
You can request a quote for p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for p-((2,4-Diamino-6-methyl-5-pyrimidinyl)azo)benzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.