9H-Purin-6-amine, 2-chloro-9-methyl-
TL;DR: 9H-Purin-6-amine, 2-chloro-9-methyl- (CAS 7013-21-0) is a chemical compound with molecular formula C6H6ClN5 and molecular weight 183.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-9-methylpurin-6-amine
Also Known As: 2-Chloro-9-methyl-9H-purin-6-amine, 2-chloro-9-methylpurin-6-amine, 2-chloro-9-methyladenine, 6-Amino-2-chloro-9-methylpurine, 9H-Purin-6-amine, 2-chloro-9-methyl-
| Molecular Formula | C6H6ClN5 |
|---|---|
| Molecular Weight | 183.03 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 183.03117 |
| Heavy Atoms | 12 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 7013-21-0 |
|---|---|
| SMILES | CN1C=NC2=C(N=C(N=C21)Cl)N |
| InChIKey | XBMKMJLOOAHOKH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9H-Purin-6-amine, 2-chloro-9-methyl- (CAS 7013-21-0), with molecular formula C6H6ClN5 and molecular weight 183.03 g/mol. IUPAC: 2-chloro-9-methylpurin-6-amine.
Chemical Property Profile of 9H-Purin-6-amine, 2-chloro-9-methyl-
Property Insights of 9H-Purin-6-amine, 2-chloro-9-methyl-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9H-Purin-6-amine, 2-chloro-9-methyl-. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 9H-Purin-6-amine, 2-chloro-9-methyl-. Following Lipinski's Rule of Five, 9H-Purin-6-amine, 2-chloro-9-methyl- 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 9H-Purin-6-amine, 2-chloro-9-methyl-?
The CAS number of 9H-Purin-6-amine, 2-chloro-9-methyl- is 7013-21-0.
What is the molecular formula of 9H-Purin-6-amine, 2-chloro-9-methyl-?
The molecular formula of 9H-Purin-6-amine, 2-chloro-9-methyl- is C6H6ClN5.
What is the molecular weight of 9H-Purin-6-amine, 2-chloro-9-methyl-?
The molecular weight of 9H-Purin-6-amine, 2-chloro-9-methyl- is 183.03 g/mol.
Where can I buy 9H-Purin-6-amine, 2-chloro-9-methyl-?
You can request a quote for 9H-Purin-6-amine, 2-chloro-9-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9H-Purin-6-amine, 2-chloro-9-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 9H-Purin-6-amine, 2-chloro-9-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.