1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone
TL;DR: 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone (CAS 1004236-43-4) is a chemical compound with molecular formula C21H23N5O and molecular weight 361.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-methyl-1-(2-phenyl-6-piperidin-1-ylpyrimidin-4-yl)pyrazol-4-yl]ethanone
Also Known As: 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone, 1-[5-methyl-1-(2-phenyl-6-piperidin-1-ylpyrimidin-4-yl)pyrazol-4-yl]ethanone, 1-{5-methyl-1-[2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}ethanone
| Molecular Formula | C21H23N5O |
|---|---|
| Molecular Weight | 361.19 g/mol |
| LogP | 3.83062 |
| Topological Polar Surface Area | 63.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.19025 |
| Heavy Atoms | 27 |
| Complexity | 957.95825 |
Chemical Identifiers
| CAS Number | 1004236-43-4 |
|---|---|
| SMILES | CC1=C(C=NN1C2=CC(=NC(=N2)C3=CC=CC=C3)N4CCCCC4)C(=O)C |
Product Overview
1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone (CAS 1004236-43-4), with molecular formula C21H23N5O and molecular weight 361.19 g/mol. IUPAC: 1-[5-methyl-1-(2-phenyl-6-piperidin-1-ylpyrimidin-4-yl)pyrazol-4-yl]ethanone.
Chemical Property Profile of 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone
Property Insights of 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone
The XLogP value of 3.83062 indicates that 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone. Following Lipinski's Rule of Five, 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone 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-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone?
The CAS number of 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone is 1004236-43-4.
What is the molecular formula of 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone?
The molecular formula of 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone is C21H23N5O.
What is the molecular weight of 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone?
The molecular weight of 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone is 361.19 g/mol.
Where can I buy 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone?
You can request a quote for 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-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-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-methyl-1-(2-phenyl-6-(piperidin-1-yl)pyrimidin-4-yl)-1H-pyrazol-4-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.