4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate
TL;DR: 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate (CAS 7495-23-0) is a chemical compound with molecular formula C15H25N4O6P and molecular weight 388.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate
Also Known As: 4-(1,3-dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate, 7-(4-diethoxyphosphoryloxybutyl)-1,3-dimethyl-purine-2,6-dione, 4-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)butyl diethyl phosphate
| Molecular Formula | C15H25N4O6P |
|---|---|
| Molecular Weight | 388.15 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 388.15118 |
| Heavy Atoms | 26 |
| Complexity | 552.0 |
Chemical Identifiers
| CAS Number | 7495-23-0 |
|---|---|
| SMILES | CCOP(=O)(OCC)OCCCCN1C=NC2=C1C(=O)N(C(=O)N2C)C |
| InChIKey | SBHILEUOKHGWRA-UHFFFAOYSA-N |
Product Overview
4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate (CAS 7495-23-0), with molecular formula C15H25N4O6P and molecular weight 388.15 g/mol. IUPAC: 4-(1,3-dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate.
Chemical Property Profile of 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate
Property Insights of 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate. Following Lipinski's Rule of Five, 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate 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 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate?
The CAS number of 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate is 7495-23-0.
What is the molecular formula of 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate?
The molecular formula of 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate is C15H25N4O6P.
What is the molecular weight of 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate?
The molecular weight of 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate is 388.15 g/mol.
Where can I buy 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate?
You can request a quote for 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,3-Dimethyl-2,6-dioxopurin-7-yl)butyl diethyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.