![2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide structure](/static/products/1005/1005593-13-4.webp)
2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide
TL;DR: 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide (CAS 1005593-13-4) is a chemical compound with molecular formula C12H10F2N4O3 and molecular weight 296.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide
Also Known As: 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide, 2,6-difluoro-N-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]benzamide
| Molecular Formula | C12H10F2N4O3 |
|---|---|
| Molecular Weight | 296.07 g/mol |
| LogP | 1.4995 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.07208 |
| Heavy Atoms | 21 |
| Complexity | 666.6421 |
Chemical Identifiers
| CAS Number | 1005593-13-4 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)F)C(=O)NCCN2C=C(C=N2)[N+](=O)[O-])F |
Product Overview
2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide (CAS 1005593-13-4), with molecular formula C12H10F2N4O3 and molecular weight 296.07 g/mol. IUPAC: 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide.
Chemical Property Profile of 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide
Property Insights of 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide
The XLogP value of 1.4995 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide. Following Lipinski's Rule of Five, 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide has 1 hydrogen bond donor(s) and 4 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 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide?
The CAS number of 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide is 1005593-13-4.
What is the molecular formula of 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide?
The molecular formula of 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide is C12H10F2N4O3.
What is the molecular weight of 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide?
The molecular weight of 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide is 296.07 g/mol.
Where can I buy 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide?
You can request a quote for 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2,6-difluoro-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.