![ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate structure](/static/products/897/897552-21-5.png)
ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate
TL;DR: ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate (CAS 897552-21-5) is a chemical compound with molecular formula C14H18N4O3 and molecular weight 290.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate
Also Known As: ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate
| Molecular Formula | C14H18N4O3 |
|---|---|
| Molecular Weight | 290.14 g/mol |
| LogP | 0.98646 |
| Topological Polar Surface Area | 89.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 290.13788 |
| Heavy Atoms | 21 |
| Complexity | 710.0557 |
Chemical Identifiers
| CAS Number | 897552-21-5 |
|---|---|
| SMILES | CCOC(=O)CC1=C(C(=O)N(N1)C2=NC(=CC(=N2)C)C)C |
Product Overview
ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate (CAS 897552-21-5), with molecular formula C14H18N4O3 and molecular weight 290.14 g/mol. IUPAC: ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate.
Chemical Property Profile of ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate
Property Insights of ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate
The XLogP value of 0.98646 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate. The TPSA of 89.87 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate. Following Lipinski's Rule of Five, ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate has 1 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 ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate?
The CAS number of ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate is 897552-21-5.
What is the molecular formula of ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate?
The molecular formula of ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate is C14H18N4O3.
What is the molecular weight of ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate?
The molecular weight of ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate is 290.14 g/mol.
Where can I buy ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate?
You can request a quote for ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[2-(4,6-dimethylpyrimidin-2-yl)-4-methyl-3-oxo-1H-pyrazol-5-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.