![1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone structure](/static/products/100/1003774-77-3.png)
1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone
TL;DR: 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone (CAS 1003774-77-3) is a chemical compound with molecular formula C23H21N5O2 and molecular weight 399.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone
Also Known As: 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone, 1-(1-(6-((4-methoxyphenyl)amino)-2-phenylpyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl)ethanone, 1-(1-{6-[(4-methoxyphenyl)amino]-2-phenylpyrimidin-4-yl}-5-methyl-1H-pyrazol-4-yl)ethanone
| Molecular Formula | C23H21N5O2 |
|---|---|
| Molecular Weight | 399.17 g/mol |
| LogP | 4.59252 |
| Topological Polar Surface Area | 81.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 399.16953 |
| Heavy Atoms | 30 |
| Complexity | 1184.2063 |
Chemical Identifiers
| CAS Number | 1003774-77-3 |
|---|---|
| SMILES | CC1=C(C=NN1C2=NC(=NC(=C2)NC3=CC=C(C=C3)OC)C4=CC=CC=C4)C(=O)C |
Product Overview
1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone (CAS 1003774-77-3), with molecular formula C23H21N5O2 and molecular weight 399.17 g/mol. IUPAC: 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone.
Chemical Property Profile of 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone
Property Insights of 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone
The XLogP value of 4.59252 indicates that 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone. Following Lipinski's Rule of Five, 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone 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 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone?
The CAS number of 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone is 1003774-77-3.
What is the molecular formula of 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone?
The molecular formula of 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone is C23H21N5O2.
What is the molecular weight of 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone?
The molecular weight of 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone is 399.17 g/mol.
Where can I buy 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone?
You can request a quote for 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-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-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[1-[6-(4-methoxyanilino)-2-phenylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.