![4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide structure](/static/products/1699/169945-49-7.webp)
4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide
TL;DR: 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide (CAS 169945-49-7) is a chemical compound with molecular formula C14H9F3N2O3 and molecular weight 310.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide
Also Known As: 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide, BAS 00440996, 4-Nitro-N-(2-(trifluoromethyl)phenyl)benzamide, 4-Nitro-N-(2-trifluoromethylphenyl)benzamide, 4-Nitro-N-(2-trifluoromethyl-phenyl)-benzamide
| Molecular Formula | C14H9F3N2O3 |
|---|---|
| Molecular Weight | 310.06 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 310.05652 |
| Heavy Atoms | 22 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 169945-49-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(F)(F)F)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | LFHQVOUOJFCYIJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide (CAS 169945-49-7), with molecular formula C14H9F3N2O3 and molecular weight 310.06 g/mol. IUPAC: 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide.
Chemical Property Profile of 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide
Property Insights of 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide. Following Lipinski's Rule of Five, 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide 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 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide?
The CAS number of 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide is 169945-49-7.
What is the molecular formula of 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide?
The molecular formula of 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide is C14H9F3N2O3.
What is the molecular weight of 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide?
The molecular weight of 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide is 310.06 g/mol.
Where can I buy 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide?
You can request a quote for 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-nitro-N-[2-(trifluoromethyl)phenyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.