PMET
TL;DR: PMET (CAS 116455-17-5) is a chemical compound with molecular formula C8H13N2O6P and molecular weight 264.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-methyl-2,4-dioxopyrimidin-1-yl)ethoxymethylphosphonic acid
Also Known As: PMET, 2-Phosphonylmethoxyethyl-thymine, 1-[2-(phosphonomethoxy)ethyl]thymine, 2-purin-9-ylethoxymethylphosphonic acid, Phosphonic acid, ((2-(3,4-dihydro-5-methyl-2,4-dioxo-1(2H)-pyrimidinyl)ethoxy)methyl)-
| Molecular Formula | C8H13N2O6P |
|---|---|
| Molecular Weight | 264.05 g/mol |
| LogP | -2.4 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 264.05112 |
| Heavy Atoms | 17 |
| Complexity | 401.0 |
Chemical Identifiers
| CAS Number | 116455-17-5 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)CCOCP(=O)(O)O |
| InChIKey | RCQMOSJJIVCPJO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
PMET (CAS 116455-17-5), with molecular formula C8H13N2O6P and molecular weight 264.05 g/mol. IUPAC: 2-(5-methyl-2,4-dioxopyrimidin-1-yl)ethoxymethylphosphonic acid.
Chemical Property Profile of PMET
Property Insights of PMET
The XLogP value of -2.4 indicates that PMET is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for PMET. Following Lipinski's Rule of Five, PMET has 3 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 PMET?
The CAS number of PMET is 116455-17-5.
What is the molecular formula of PMET?
The molecular formula of PMET is C8H13N2O6P.
What is the molecular weight of PMET?
The molecular weight of PMET is 264.05 g/mol.
Where can I buy PMET?
You can request a quote for PMET directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for PMET?
Yes, KEHONG BIO provides custom synthesis services for PMET and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.