1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one
TL;DR: 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one (CAS 98792-85-9) is a chemical compound with molecular formula C8H10N2O3 and molecular weight 182.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,6-dimethoxypyrimidin-5-yl)ethanone
Also Known As: 4,6-Dimethoxy-5-acetylpyrimidine, 1-(4,6-dimethoxypyrimidin-5-yl)ethan-1-one, 1-(4,6-dimethoxypyrimidin-5-yl)ethanone, Pyrimidine, 4,6-dimethoxy-5-acetyl-, 1-(4,6-Dimethoxy-5-pyrimidinyl)ethanone #
| Molecular Formula | C8H10N2O3 |
|---|---|
| Molecular Weight | 182.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 61.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 182.06914 |
| Heavy Atoms | 13 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 98792-85-9 |
|---|---|
| SMILES | CC(=O)C1=C(N=CN=C1OC)OC |
| InChIKey | LAPSNRHJNYFYPH-UHFFFAOYSA-N |
Product Overview
1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one (CAS 98792-85-9), with molecular formula C8H10N2O3 and molecular weight 182.07 g/mol. IUPAC: 1-(4,6-dimethoxypyrimidin-5-yl)ethanone.
Chemical Property Profile of 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one
Property Insights of 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one. The TPSA of 61.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one. Following Lipinski's Rule of Five, 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one has 0 hydrogen bond donor(s) and 5 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 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one?
The CAS number of 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one is 98792-85-9.
What is the molecular formula of 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one?
The molecular formula of 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one is C8H10N2O3.
What is the molecular weight of 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one?
The molecular weight of 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one is 182.07 g/mol.
Where can I buy 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one?
You can request a quote for 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4,6-Dimethoxypyrimidin-5-yl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.