![4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide structure](/static/products/2946/294654-51-6.webp)
4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide
TL;DR: 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide (CAS 294654-51-6) is a chemical compound with molecular formula C16H14Cl3N3O3 and molecular weight 401.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide
Also Known As: 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide, 4-nitro-N-{2,2,2-trichloro-1-[(4-methylphenyl)amino]ethyl}benzamide
| Molecular Formula | C16H14Cl3N3O3 |
|---|---|
| Molecular Weight | 401.01 g/mol |
| LogP | 4.44142 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.01007 |
| Heavy Atoms | 25 |
| Complexity | 758.9347 |
Chemical Identifiers
| CAS Number | 294654-51-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(C(Cl)(Cl)Cl)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide (CAS 294654-51-6), with molecular formula C16H14Cl3N3O3 and molecular weight 401.01 g/mol. IUPAC: 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide.
Chemical Property Profile of 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide
Property Insights of 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide
The XLogP value of 4.44142 indicates that 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide. Following Lipinski's Rule of Five, 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide has 2 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 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide?
The CAS number of 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide is 294654-51-6.
What is the molecular formula of 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide?
The molecular formula of 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide is C16H14Cl3N3O3.
What is the molecular weight of 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide?
The molecular weight of 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide is 401.01 g/mol.
Where can I buy 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide?
You can request a quote for 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]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-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-nitro-N-[2,2,2-trichloro-1-(4-methylanilino)ethyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.