9-(4-Chlorobutyl)-9h-purin-6-amine
TL;DR: 9-(4-Chlorobutyl)-9h-purin-6-amine (CAS 6947-13-3) is a chemical compound with molecular formula C9H12ClN5 and molecular weight 225.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(4-chlorobutyl)purin-6-amine
Also Known As: 9-(4-chlorobutyl)-9h-purin-6-amine, 9-(4-chlorobutyl)purin-6-amine, N9-(4-chlorobutyl)adenine, 9-Chlor-anthracen-10-carbonsaeure
| Molecular Formula | C9H12ClN5 |
|---|---|
| Molecular Weight | 225.08 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.07812 |
| Heavy Atoms | 15 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 6947-13-3 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C=N2)CCCCCl)N |
| InChIKey | JOSMPXYVHRJDAU-UHFFFAOYSA-N |
Product Overview
9-(4-Chlorobutyl)-9h-purin-6-amine (CAS 6947-13-3), with molecular formula C9H12ClN5 and molecular weight 225.08 g/mol. IUPAC: 9-(4-chlorobutyl)purin-6-amine.
Chemical Property Profile of 9-(4-Chlorobutyl)-9h-purin-6-amine
Property Insights of 9-(4-Chlorobutyl)-9h-purin-6-amine
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-(4-Chlorobutyl)-9h-purin-6-amine. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-(4-Chlorobutyl)-9h-purin-6-amine. Following Lipinski's Rule of Five, 9-(4-Chlorobutyl)-9h-purin-6-amine has 1 hydrogen bond donor(s) and 4 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-(4-Chlorobutyl)-9h-purin-6-amine?
The CAS number of 9-(4-Chlorobutyl)-9h-purin-6-amine is 6947-13-3.
What is the molecular formula of 9-(4-Chlorobutyl)-9h-purin-6-amine?
The molecular formula of 9-(4-Chlorobutyl)-9h-purin-6-amine is C9H12ClN5.
What is the molecular weight of 9-(4-Chlorobutyl)-9h-purin-6-amine?
The molecular weight of 9-(4-Chlorobutyl)-9h-purin-6-amine is 225.08 g/mol.
Where can I buy 9-(4-Chlorobutyl)-9h-purin-6-amine?
You can request a quote for 9-(4-Chlorobutyl)-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-(4-Chlorobutyl)-9h-purin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for 9-(4-Chlorobutyl)-9h-purin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.