Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate
TL;DR: Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate (CAS 70299-73-9) is a chemical compound with molecular formula C15H27N6O5P and molecular weight 402.18 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)ethylamino]-[3-(trimethylazaniumyl)propoxy]phosphinate
Also Known As: Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate, Theophyllinyl-7' ethylamidophosphate de (trimethylammonium-3) propyle [French], Theophyllinyl-7' ethylamidophosphate de (trimethylammonium-3) propyle, [2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethylamino]-[3-(trimethylazaniumyl)propoxy]phosphinate, BRN 4165484
| Molecular Formula | C15H27N6O5P |
|---|---|
| Molecular Weight | 402.18 g/mol |
| LogP | -1.3954 |
| Topological Polar Surface Area | 123.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 402.17807 |
| Heavy Atoms | 27 |
| Complexity | 969.94867 |
Chemical Identifiers
| CAS Number | 70299-73-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCNP(=O)([O-])OCCC[N+](C)(C)C |
Product Overview
Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate (CAS 70299-73-9), with molecular formula C15H27N6O5P and molecular weight 402.18 g/mol. IUPAC: [2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethylamino]-[3-(trimethylazaniumyl)propoxy]phosphinate.
Chemical Property Profile of Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate
Property Insights of Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate
The XLogP value of -1.3954 indicates that Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 123.21 Ų falls within the moderate polarity range, balancing permeability and solubility for Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate. Following Lipinski's Rule of Five, Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate has 1 hydrogen bond donor(s) and 6 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 Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate?
The CAS number of Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate is 70299-73-9.
What is the molecular formula of Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate?
The molecular formula of Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate is C15H27N6O5P.
What is the molecular weight of Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate?
The molecular weight of Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate is 402.18 g/mol.
Where can I buy Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate?
You can request a quote for Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (3-hydroxypropyl)trimethyl-, ester with N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl) phosphoramidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.