Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate
TL;DR: Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate (CAS 4230-55-1) is a chemical compound with molecular formula C7H14N5O3P and molecular weight 247.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-diethoxyphosphoryl-1,3,5-triazine-2,4-diamine
Also Known As: diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate, 6-diethoxyphosphoryl-1,3,5-triazine-2,4-diamine, Diethyl (4,6-diamino-1,3,5-triazin-2-yl)phosphonate, J1.736.569J, diethyl 4,6-diamino-1,3,5-triazine-2-yl phosphonate
| Molecular Formula | C7H14N5O3P |
|---|---|
| Molecular Weight | 247.08 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 247.08342 |
| Heavy Atoms | 16 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 4230-55-1 |
|---|---|
| SMILES | CCOP(=O)(C1=NC(=NC(=N1)N)N)OCC |
| InChIKey | DDMIIIHVHWXZLV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate (CAS 4230-55-1), with molecular formula C7H14N5O3P and molecular weight 247.08 g/mol. IUPAC: 6-diethoxyphosphoryl-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate
Property Insights of Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate
The XLogP value of -0.5 indicates that Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate. Following Lipinski's Rule of Five, Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate has 2 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 Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate?
The CAS number of Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate is 4230-55-1.
What is the molecular formula of Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate?
The molecular formula of Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate is C7H14N5O3P.
What is the molecular weight of Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate?
The molecular weight of Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate is 247.08 g/mol.
Where can I buy Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate?
You can request a quote for Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl(4,6-diamino-1,3,5-triazin-2-yl)phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.