![3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime structure](/static/products/3831/383147-19-1.webp)
3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime
TL;DR: 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime (CAS 383147-19-1) is a chemical compound with molecular formula C20H19F3N4O4 and molecular weight 436.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[4-(methoxyiminomethyl)-2-nitrophenyl]piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone
Also Known As: 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime, [4-[4-(methoxyiminomethyl)-2-nitrophenyl]piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone
| Molecular Formula | C20H19F3N4O4 |
|---|---|
| Molecular Weight | 436.14 g/mol |
| LogP | 3.5563 |
| Topological Polar Surface Area | 88.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 436.13583 |
| Heavy Atoms | 31 |
| Complexity | 1002.1597 |
Chemical Identifiers
| CAS Number | 383147-19-1 |
|---|---|
| SMILES | CON=CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)C(F)(F)F)[N+](=O)[O-] |
Product Overview
3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime (CAS 383147-19-1), with molecular formula C20H19F3N4O4 and molecular weight 436.14 g/mol. IUPAC: [4-[4-(methoxyiminomethyl)-2-nitrophenyl]piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone.
Chemical Property Profile of 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime
Property Insights of 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime
The XLogP value of 3.5563 indicates that 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime. Following Lipinski's Rule of Five, 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime 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 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime?
The CAS number of 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime is 383147-19-1.
What is the molecular formula of 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime?
The molecular formula of 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime is C20H19F3N4O4.
What is the molecular weight of 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime?
The molecular weight of 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime is 436.14 g/mol.
Where can I buy 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime?
You can request a quote for 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime?
Yes, KEHONG BIO provides custom synthesis services for 3-nitro-4-{4-[3-(trifluoromethyl)benzoyl]piperazino}benzenecarbaldehyde O-methyloxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.