![1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide structure](/static/products/445/445022-39-9.png)
1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide
TL;DR: 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide (CAS 445022-39-9) is a chemical compound with molecular formula C20H19Cl2FN4O3 and molecular weight 452.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide
Also Known As: 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide, 1-(2-chloro-4-fluorobenzyl)-N'-{4-chloro-3-nitrobenzylidene}-4-piperidinecarbohydrazide, 1-(2-chloro-4-fluorobenzyl)-N'-[(E)-(4-chloro-3-nitrophenyl)methylidene]piperidine-4-carbohydrazide, 1-(2-CHLORO-4-FLUOROBENZYL)-N'~4~-[(E)-1-(4-CHLORO-3-NITROPHENYL)METHYLIDENE]-4-PIPERIDINECARBOHYDRAZIDE
| Molecular Formula | C20H19Cl2FN4O3 |
|---|---|
| Molecular Weight | 452.08 g/mol |
| LogP | 4.403 |
| Topological Polar Surface Area | 87.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 452.08182 |
| Heavy Atoms | 30 |
| Complexity | 978.5191 |
Chemical Identifiers
| CAS Number | 445022-39-9 |
|---|---|
| SMILES | C1CN(CCC1C(=O)N/N=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-])CC3=C(C=C(C=C3)F)Cl |
Product Overview
1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide (CAS 445022-39-9), with molecular formula C20H19Cl2FN4O3 and molecular weight 452.08 g/mol. IUPAC: 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide.
Chemical Property Profile of 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide
Property Insights of 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide
The XLogP value of 4.403 indicates that 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide. Following Lipinski's Rule of Five, 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide has 1 hydrogen bond donor(s) and 5 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 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide?
The CAS number of 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide is 445022-39-9.
What is the molecular formula of 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide?
The molecular formula of 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide is C20H19Cl2FN4O3.
What is the molecular weight of 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide?
The molecular weight of 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide is 452.08 g/mol.
Where can I buy 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide?
You can request a quote for 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]piperidine-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.