![N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide structure](/static/products/897/897552-22-6.png)
N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide
TL;DR: N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide (CAS 897552-22-6) is a chemical compound with molecular formula C18H16N6O and molecular weight 332.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-cyano-1-(4,6-dimethylpyrimidin-2-yl)pyrazol-5-yl]-4-methylbenzamide
Also Known As: ASN 14594413, N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide, N-[4-cyano-1-(4,6-dimethylpyrimidin-2-yl)-1H-pyrazol-5-yl]-4-methylbenzamide, N-(4-cyano-1-(4,6-dimethylpyrimidin-2-yl)-1H-pyrazol-5-yl)-4-methylbenzamide, N-[1-(4,6-dimethylpyrimidin-2-yl)-4-cyanopyrazol-5-yl](4-methylphenyl)carboxam ide
| Molecular Formula | C18H16N6O |
|---|---|
| Molecular Weight | 332.14 g/mol |
| LogP | 2.71154 |
| Topological Polar Surface Area | 96.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.13855 |
| Heavy Atoms | 25 |
| Complexity | 961.54114 |
Chemical Identifiers
| CAS Number | 897552-22-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NC2=C(C=NN2C3=NC(=CC(=N3)C)C)C#N |
Product Overview
N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide (CAS 897552-22-6), with molecular formula C18H16N6O and molecular weight 332.14 g/mol. IUPAC: N-[4-cyano-1-(4,6-dimethylpyrimidin-2-yl)pyrazol-5-yl]-4-methylbenzamide.
Chemical Property Profile of N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide
Property Insights of N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide
The XLogP value of 2.71154 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide. The TPSA of 96.49 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide. Following Lipinski's Rule of Five, N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide 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 N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide?
The CAS number of N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide is 897552-22-6.
What is the molecular formula of N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide?
The molecular formula of N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide is C18H16N6O.
What is the molecular weight of N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide?
The molecular weight of N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide is 332.14 g/mol.
Where can I buy N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide?
You can request a quote for N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.