Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester
TL;DR: Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester (CAS 69387-72-0) is a chemical compound with molecular formula C11H17N4O6P and molecular weight 332.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl dimethyl phosphate
Also Known As: Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester, 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl dimethyl phosphate, 2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)ethyl dimethyl phosphate, 2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl dimethyl phosphate, Phosphoric acid dimethyl 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl ester
| Molecular Formula | C11H17N4O6P |
|---|---|
| Molecular Weight | 332.09 g/mol |
| LogP | -0.1488 |
| Topological Polar Surface Area | 106.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 332.08856 |
| Heavy Atoms | 22 |
| Complexity | 842.6099 |
Chemical Identifiers
| CAS Number | 69387-72-0 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCOP(=O)(OC)OC |
Product Overview
Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester (CAS 69387-72-0), with molecular formula C11H17N4O6P and molecular weight 332.09 g/mol. IUPAC: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl dimethyl phosphate.
Chemical Property Profile of Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester
Property Insights of Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester
The XLogP value of -0.1488 indicates that Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 106.58 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester. Following Lipinski's Rule of Five, Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester has 0 hydrogen bond donor(s) and 7 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 Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester?
The CAS number of Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester is 69387-72-0.
What is the molecular formula of Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester?
The molecular formula of Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester is C11H17N4O6P.
What is the molecular weight of Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester?
The molecular weight of Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester is 332.09 g/mol.
Where can I buy Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester?
You can request a quote for Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphoric acid, dimethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.