6-Chloro-9-methoxymethylpurine
TL;DR: 6-Chloro-9-methoxymethylpurine (CAS 6504-64-9) is a chemical compound with molecular formula C7H7ClN4O and molecular weight 198.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-9-(methoxymethyl)purine
Also Known As: 6-Chloro-9-methoxymethylpurine, 6-Chloro-9-(methoxymethyl)-9H-purine, 6-chloro-9-(methoxymethyl)purine, 9H-Purine, 6-chloro-9-(methoxymethyl)-, 9-methoxymethyl-6-chloropurine
| Molecular Formula | C7H7ClN4O |
|---|---|
| Molecular Weight | 198.03 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 52.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.03084 |
| Heavy Atoms | 13 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 6504-64-9 |
|---|---|
| SMILES | COCN1C=NC2=C1N=CN=C2Cl |
| InChIKey | SZLMRHFSYVCXQX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Chloro-9-methoxymethylpurine (CAS 6504-64-9), with molecular formula C7H7ClN4O and molecular weight 198.03 g/mol. IUPAC: 6-chloro-9-(methoxymethyl)purine.
Chemical Property Profile of 6-Chloro-9-methoxymethylpurine
Property Insights of 6-Chloro-9-methoxymethylpurine
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-9-methoxymethylpurine. With a topological polar surface area (TPSA) of 52.8 Ų, 6-Chloro-9-methoxymethylpurine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-9-methoxymethylpurine has 0 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 6-Chloro-9-methoxymethylpurine?
The CAS number of 6-Chloro-9-methoxymethylpurine is 6504-64-9.
What is the molecular formula of 6-Chloro-9-methoxymethylpurine?
The molecular formula of 6-Chloro-9-methoxymethylpurine is C7H7ClN4O.
What is the molecular weight of 6-Chloro-9-methoxymethylpurine?
The molecular weight of 6-Chloro-9-methoxymethylpurine is 198.03 g/mol.
Where can I buy 6-Chloro-9-methoxymethylpurine?
You can request a quote for 6-Chloro-9-methoxymethylpurine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-9-methoxymethylpurine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-9-methoxymethylpurine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.