Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate
TL;DR: Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate (CAS 38802-82-3) is a chemical compound with molecular formula C10H17N2O4P and molecular weight 260.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (6-methyl-2-propan-2-ylpyrimidin-4-yl) hydrogen phosphate
Also Known As: Desethyl diazoxon, ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate, Ethyl (2-isopropyl-6-methylpyrimidin-4-yl) hydrogen phosphate, ethyl (6-methyl-2-propan-2-ylpyrimidin-4-yl) hydrogen phosphate, Ethoxy-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)oxy-phosphinic Acid
| Molecular Formula | C10H17N2O4P |
|---|---|
| Molecular Weight | 260.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 81.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 260.0926 |
| Heavy Atoms | 17 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 38802-82-3 |
|---|---|
| SMILES | CCOP(=O)(O)OC1=NC(=NC(=C1)C)C(C)C |
| InChIKey | YBQSUZWYYMESQO-UHFFFAOYSA-N |
Product Overview
Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate (CAS 38802-82-3), with molecular formula C10H17N2O4P and molecular weight 260.09 g/mol. IUPAC: ethyl (6-methyl-2-propan-2-ylpyrimidin-4-yl) hydrogen phosphate.
Chemical Property Profile of Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate
Property Insights of Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate. The TPSA of 81.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate. Following Lipinski's Rule of Five, Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate 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 Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate?
The CAS number of Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate is 38802-82-3.
What is the molecular formula of Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate?
The molecular formula of Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate is C10H17N2O4P.
What is the molecular weight of Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate?
The molecular weight of Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate is 260.09 g/mol.
Where can I buy Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate?
You can request a quote for Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl hydrogen phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.