N-(3-chlorophenyl)-5H-purin-6-amine
TL;DR: N-(3-chlorophenyl)-5H-purin-6-amine (CAS 5444-43-9) is a chemical compound with molecular formula C11H8ClN5 and molecular weight 245.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-5H-purin-6-amine
Also Known As: N-(3-chlorophenyl)-5H-purin-6-amine
| Molecular Formula | C11H8ClN5 |
|---|---|
| Molecular Weight | 245.05 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 61.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.04683 |
| Heavy Atoms | 17 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 5444-43-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NC2=NC=NC3=NC=NC32 |
| InChIKey | LRKAZGGVXFQWBN-UHFFFAOYSA-N |
Product Overview
N-(3-chlorophenyl)-5H-purin-6-amine (CAS 5444-43-9), with molecular formula C11H8ClN5 and molecular weight 245.05 g/mol. IUPAC: N-(3-chlorophenyl)-5H-purin-6-amine.
Chemical Property Profile of N-(3-chlorophenyl)-5H-purin-6-amine
Property Insights of N-(3-chlorophenyl)-5H-purin-6-amine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chlorophenyl)-5H-purin-6-amine. The TPSA of 61.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chlorophenyl)-5H-purin-6-amine. Following Lipinski's Rule of Five, N-(3-chlorophenyl)-5H-purin-6-amine has 1 hydrogen bond donor(s) and 1 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 N-(3-chlorophenyl)-5H-purin-6-amine?
The CAS number of N-(3-chlorophenyl)-5H-purin-6-amine is 5444-43-9.
What is the molecular formula of N-(3-chlorophenyl)-5H-purin-6-amine?
The molecular formula of N-(3-chlorophenyl)-5H-purin-6-amine is C11H8ClN5.
What is the molecular weight of N-(3-chlorophenyl)-5H-purin-6-amine?
The molecular weight of N-(3-chlorophenyl)-5H-purin-6-amine is 245.05 g/mol.
Where can I buy N-(3-chlorophenyl)-5H-purin-6-amine?
You can request a quote for N-(3-chlorophenyl)-5H-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 N-(3-chlorophenyl)-5H-purin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chlorophenyl)-5H-purin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.