![[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone structure](/static/products/593/593237-49-1.png)
[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone
TL;DR: [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone (CAS 593237-49-1) is a chemical compound with molecular formula C19H17F3N4O5 and molecular weight 438.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone
Also Known As: [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone|(4-(2,6-dinitro-4-(trifluoromethyl)phenyl)piperazin-1-yl)(m-tolyl)methanone|{4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}(3-methylphenyl)methanone
| Molecular Formula | C19H17F3N4O5 |
|---|---|
| Molecular Weight | 438.12 g/mol |
| LogP | 3.79262 |
| Topological Polar Surface Area | 109.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.1151 |
| Heavy Atoms | 31 |
| Complexity | 1014.07416 |
Chemical Identifiers
| CAS Number | 593237-49-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-] |
Product Overview
[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone (CAS 593237-49-1), with molecular formula C19H17F3N4O5 and molecular weight 438.12 g/mol. IUPAC: [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone.
Chemical Property Profile of [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone
Property Insights of [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone
The XLogP value of 3.79262 indicates that [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.83 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone. Following Lipinski's Rule of Five, [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone has 0 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-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone?
The CAS number of [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone is 593237-49-1.
What is the molecular formula of [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone?
The molecular formula of [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone is C19H17F3N4O5.
What is the molecular weight of [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone?
The molecular weight of [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone is 438.12 g/mol.
Where can I buy [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone?
You can request a quote for [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-methylphenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.