9-(3-Nitrophenyl)-9h-purin-6-amine
TL;DR: 9-(3-Nitrophenyl)-9h-purin-6-amine (CAS 5356-52-5) is a chemical compound with molecular formula C11H8N6O2 and molecular weight 256.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(3-nitrophenyl)purin-6-amine
Also Known As: 9-(3-nitrophenyl)-9h-purin-6-amine, 9-(p-Nitrophenyl)adenine, 9-(3-nitrophenyl)purin-6-amine, N(sup 9)-(p-Nitrophenyl)adenine, 9H-Purin-6-amine, 9-(4-nitrophenyl)-
| Molecular Formula | C11H8N6O2 |
|---|---|
| Molecular Weight | 256.07 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 256.07086 |
| Heavy Atoms | 19 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 5356-52-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])N2C=NC3=C(N=CN=C32)N |
| InChIKey | OETJYVAQRPLYIS-UHFFFAOYSA-N |
Product Overview
9-(3-Nitrophenyl)-9h-purin-6-amine (CAS 5356-52-5), with molecular formula C11H8N6O2 and molecular weight 256.07 g/mol. IUPAC: 9-(3-nitrophenyl)purin-6-amine.
Chemical Property Profile of 9-(3-Nitrophenyl)-9h-purin-6-amine
Property Insights of 9-(3-Nitrophenyl)-9h-purin-6-amine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-(3-Nitrophenyl)-9h-purin-6-amine. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-(3-Nitrophenyl)-9h-purin-6-amine. Following Lipinski's Rule of Five, 9-(3-Nitrophenyl)-9h-purin-6-amine has 1 hydrogen bond donor(s) and 6 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 9-(3-Nitrophenyl)-9h-purin-6-amine?
The CAS number of 9-(3-Nitrophenyl)-9h-purin-6-amine is 5356-52-5.
What is the molecular formula of 9-(3-Nitrophenyl)-9h-purin-6-amine?
The molecular formula of 9-(3-Nitrophenyl)-9h-purin-6-amine is C11H8N6O2.
What is the molecular weight of 9-(3-Nitrophenyl)-9h-purin-6-amine?
The molecular weight of 9-(3-Nitrophenyl)-9h-purin-6-amine is 256.07 g/mol.
Where can I buy 9-(3-Nitrophenyl)-9h-purin-6-amine?
You can request a quote for 9-(3-Nitrophenyl)-9h-purin-6-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-(3-Nitrophenyl)-9h-purin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for 9-(3-Nitrophenyl)-9h-purin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.