6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine
TL;DR: 6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine (CAS 183194-25-4) is a chemical compound with molecular formula C14H23ClN5O4P and molecular weight 391.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-9-[2-[di(propan-2-yloxy)phosphorylmethoxy]ethyl]purin-2-amine
Also Known As: J1.698.166D, Diisopropyl [[2-(2-Amino-6-chloro-9H-purin-9-yl)ethoxy]methyl]phosphonate, 6-chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine, Bis(2-propyl)-9-[2-(phosphonomethoxy)ethyl]-2-amino-6-chloropurine, 6-Chloro-9-[2-(diisopropoxyphosphinylmethoxy)ethyl]-9H-purine-2-amine
| Molecular Formula | C14H23ClN5O4P |
|---|---|
| Molecular Weight | 391.12 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 391.1176 |
| Heavy Atoms | 25 |
| Complexity | 459.0 |
Chemical Identifiers
| CAS Number | 183194-25-4 |
|---|---|
| SMILES | CC(C)OP(=O)(COCCN1C=NC2=C1N=C(N=C2Cl)N)OC(C)C |
| InChIKey | VPODKOINXYQOJB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine (CAS 183194-25-4), with molecular formula C14H23ClN5O4P and molecular weight 391.12 g/mol. IUPAC: 6-chloro-9-[2-[di(propan-2-yloxy)phosphorylmethoxy]ethyl]purin-2-amine.
Chemical Property Profile of 6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine
Property Insights of 6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine. Following Lipinski's Rule of Five, 6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine has 1 hydrogen bond donor(s) and 8 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-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine?
The CAS number of 6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine is 183194-25-4.
What is the molecular formula of 6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine?
The molecular formula of 6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine is C14H23ClN5O4P.
What is the molecular weight of 6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine?
The molecular weight of 6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine is 391.12 g/mol.
Where can I buy 6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine?
You can request a quote for 6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine 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-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.