2-Chloro-6-methoxypurine
TL;DR: 2-Chloro-6-methoxypurine (CAS 1198-46-5) is a chemical compound with molecular formula C6H5ClN4O and molecular weight 184.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-6-methoxy-7H-purine
Also Known As: 2-Chloro-6-methoxypurine, 2-chloro-6-methoxy-9H-purine, 2-chloro-6-methoxy-7H-purine, 9H-purine, 2-chloro-6-methoxy-, Clofarabine Impurity 14
| Molecular Formula | C6H5ClN4O |
|---|---|
| Molecular Weight | 184.02 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 63.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 184.01518 |
| Heavy Atoms | 12 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 1198-46-5 |
|---|---|
| SMILES | COC1=NC(=NC2=C1NC=N2)Cl |
| InChIKey | MTDSMFYWSAISJR-UHFFFAOYSA-N |
Product Overview
2-Chloro-6-methoxypurine (CAS 1198-46-5), with molecular formula C6H5ClN4O and molecular weight 184.02 g/mol. IUPAC: 2-chloro-6-methoxy-7H-purine.
Chemical Property Profile of 2-Chloro-6-methoxypurine
Property Insights of 2-Chloro-6-methoxypurine
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-6-methoxypurine. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-6-methoxypurine. Following Lipinski's Rule of Five, 2-Chloro-6-methoxypurine 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 2-Chloro-6-methoxypurine?
The CAS number of 2-Chloro-6-methoxypurine is 1198-46-5.
What is the molecular formula of 2-Chloro-6-methoxypurine?
The molecular formula of 2-Chloro-6-methoxypurine is C6H5ClN4O.
What is the molecular weight of 2-Chloro-6-methoxypurine?
The molecular weight of 2-Chloro-6-methoxypurine is 184.02 g/mol.
Where can I buy 2-Chloro-6-methoxypurine?
You can request a quote for 2-Chloro-6-methoxypurine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-6-methoxypurine?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-6-methoxypurine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.