Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle
TL;DR: Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle (CAS 70299-76-2) is a chemical compound with molecular formula C20H29N10O6P and molecular weight 536.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[2-[[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethylamino]-ethoxyphosphoryl]amino]ethyl]-1,3-dimethylpurine-2,6-dione
Also Known As: Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle, Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle [French], Phosphorodiamidic acid, N,N'-bis(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl)-, ethyl ester, 7-[2-[[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethylamino]-ethoxyphosphoryl]amino]ethyl]-1,3-dimethylpurine-2,6-dione, 7-{2-[({[2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl]amino}(ethoxy)phosphoryl)amino]ethyl}-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
| Molecular Formula | C20H29N10O6P |
|---|---|
| Molecular Weight | 536.20 g/mol |
| LogP | -1.7952 |
| Topological Polar Surface Area | 174.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 536.2009 |
| Heavy Atoms | 37 |
| Complexity | 1647.0016 |
Chemical Identifiers
| CAS Number | 70299-76-2 |
|---|---|
| SMILES | CCOP(=O)(NCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)NCCN3C=NC4=C3C(=O)N(C(=O)N4C)C |
Product Overview
Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle (CAS 70299-76-2), with molecular formula C20H29N10O6P and molecular weight 536.20 g/mol. IUPAC: 7-[2-[[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethylamino]-ethoxyphosphoryl]amino]ethyl]-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle
Property Insights of Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle
The XLogP value of -1.7952 indicates that Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 174.0 Ų indicates high polarity, suggesting Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle?
The CAS number of Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle is 70299-76-2.
What is the molecular formula of Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle?
The molecular formula of Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle is C20H29N10O6P.
What is the molecular weight of Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle?
The molecular weight of Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle is 536.20 g/mol.
Where can I buy Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle?
You can request a quote for Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle?
Yes, KEHONG BIO provides custom synthesis services for Bis-(theophyllinyl-7' ethylamino) phosphate d'ethyle and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.