2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol
TL;DR: 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol (CAS 6641-29-8) is a chemical compound with molecular formula C17H13N5O4 and molecular weight 351.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol
Also Known As: 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol, 2,2'-[(7H-Purin-6-yl)azanediyl]di(benzene-1,4-diol), 2,2'-((7H-purin-6-yl)azanediyl)bis(benzene-1,4-diol), 2-[(2,5-dihydroxyphenyl)-(7H-purin-6-yl)amino]benzene-1,4-diol
| Molecular Formula | C17H13N5O4 |
|---|---|
| Molecular Weight | 351.10 g/mol |
| LogP | 2.6451 |
| Topological Polar Surface Area | 138.62 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 351.09674 |
| Heavy Atoms | 26 |
| Complexity | 1059.9626 |
Chemical Identifiers
| CAS Number | 6641-29-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1O)N(C2=C(C=CC(=C2)O)O)C3=NC=NC4=C3NC=N4)O |
Product Overview
2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol (CAS 6641-29-8), with molecular formula C17H13N5O4 and molecular weight 351.10 g/mol. IUPAC: 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol.
Chemical Property Profile of 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol
Property Insights of 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol
The XLogP value of 2.6451 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol. The TPSA of 138.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol. Following Lipinski's Rule of Five, 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol has 5 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 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol?
The CAS number of 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol is 6641-29-8.
What is the molecular formula of 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol?
The molecular formula of 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol is C17H13N5O4.
What is the molecular weight of 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol?
The molecular weight of 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol is 351.10 g/mol.
Where can I buy 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol?
You can request a quote for 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol?
Yes, KEHONG BIO provides custom synthesis services for 2-[2,5-dihydroxy-N-(7H-purin-6-yl)anilino]benzene-1,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.