![3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide structure](/static/products/879/879562-49-9.png)
3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide
TL;DR: 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide (CAS 879562-49-9) is a chemical compound with molecular formula C17H13ClN6O and molecular weight 352.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[4-cyano-1-(4,6-dimethylpyrimidin-2-yl)pyrazol-5-yl]benzamide
Also Known As: ASN 14594435, 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide, 3-chloro-N-[4-cyano-1-(4,6-dimethylpyrimidin-2-yl)-1H-pyrazol-5-yl]benzamide, 3-chloro-N-(4-cyano-1-(4,6-dimethylpyrimidin-2-yl)-1H-pyrazol-5-yl)benzamide, 3-Chloro-N-[4-cyano-2-(4,6-dimethyl-pyrimidin-2-yl)-2H-pyrazol-3-yl]-benzamide
| Molecular Formula | C17H13ClN6O |
|---|---|
| Molecular Weight | 352.08 g/mol |
| LogP | 3.05652 |
| Topological Polar Surface Area | 96.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.08392 |
| Heavy Atoms | 25 |
| Complexity | 984.3629 |
Chemical Identifiers
| CAS Number | 879562-49-9 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)N2C(=C(C=N2)C#N)NC(=O)C3=CC(=CC=C3)Cl)C |
Product Overview
3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide (CAS 879562-49-9), with molecular formula C17H13ClN6O and molecular weight 352.08 g/mol. IUPAC: 3-chloro-N-[4-cyano-1-(4,6-dimethylpyrimidin-2-yl)pyrazol-5-yl]benzamide.
Chemical Property Profile of 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide
Property Insights of 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide
The XLogP value of 3.05652 indicates that 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide. Following Lipinski's Rule of Five, 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide 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 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide?
The CAS number of 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide is 879562-49-9.
What is the molecular formula of 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide?
The molecular formula of 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide is C17H13ClN6O.
What is the molecular weight of 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide?
The molecular weight of 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide is 352.08 g/mol.
Where can I buy 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide?
You can request a quote for 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.