4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide
TL;DR: 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide (CAS 330633-71-1) is a chemical compound with molecular formula C17H16F3N3O3 and molecular weight 367.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide
Also Known As: BIM-0006774.P001, 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide, 4-methyl-N-(2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}ethyl)benzamide, 4-METHYL-N-{2-[2-NITRO-4-(TRIFLUOROMETHYL)ANILINO]ETHYL}BENZAMIDE, (4-methylphenyl)-N-(2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}ethyl)carboxam ide
| Molecular Formula | C17H16F3N3O3 |
|---|---|
| Molecular Weight | 367.11 g/mol |
| LogP | 3.76392 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 367.11438 |
| Heavy Atoms | 26 |
| Complexity | 805.1358 |
Chemical Identifiers
| CAS Number | 330633-71-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NCCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-] |
Product Overview
4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide (CAS 330633-71-1), with molecular formula C17H16F3N3O3 and molecular weight 367.11 g/mol. IUPAC: 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide.
Chemical Property Profile of 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide
Property Insights of 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide
The XLogP value of 3.76392 indicates that 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]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-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide. Following Lipinski's Rule of Five, 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]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-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide?
The CAS number of 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide is 330633-71-1.
What is the molecular formula of 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide?
The molecular formula of 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide is C17H16F3N3O3.
What is the molecular weight of 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide?
The molecular weight of 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide is 367.11 g/mol.
Where can I buy 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide?
You can request a quote for 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]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-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.