![1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone structure](/static/products/100/1004236-49-0.png)
1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone
TL;DR: 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone (CAS 1004236-49-0) is a chemical compound with molecular formula C22H26N6O and molecular weight 390.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone
Also Known As: 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone, 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone, 1-(1-(6-(4-ethylpiperazin-1-yl)-2-phenylpyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl)ethanone, 1-{1-[6-(4-ethylpiperazin-1-yl)-2-phenylpyrimidin-4-yl]-5-methyl-1H-pyrazol-4-yl}ethanone
| Molecular Formula | C22H26N6O |
|---|---|
| Molecular Weight | 390.22 g/mol |
| LogP | 2.98222 |
| Topological Polar Surface Area | 67.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.2168 |
| Heavy Atoms | 29 |
| Complexity | 1005.3969 |
Chemical Identifiers
| CAS Number | 1004236-49-0 |
|---|---|
| SMILES | CCN1CCN(CC1)C2=NC(=NC(=C2)N3C(=C(C=N3)C(=O)C)C)C4=CC=CC=C4 |
Product Overview
1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone (CAS 1004236-49-0), with molecular formula C22H26N6O and molecular weight 390.22 g/mol. IUPAC: 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone.
Chemical Property Profile of 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone
Property Insights of 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone
The XLogP value of 2.98222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone. The TPSA of 67.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone. Following Lipinski's Rule of Five, 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone has 0 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 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone?
The CAS number of 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone is 1004236-49-0.
What is the molecular formula of 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone?
The molecular formula of 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone is C22H26N6O.
What is the molecular weight of 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone?
The molecular weight of 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone is 390.22 g/mol.
Where can I buy 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone?
You can request a quote for 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[1-[6-(4-ethylpiperazin-1-yl)-2-phenyl-pyrimidin-4-yl]-5-methyl-pyrazol-4-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.