1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide
TL;DR: 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide (CAS 444931-48-0) is a chemical compound with molecular formula C23H27ClFN3O4 and molecular weight 463.17 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)-(2,4,5-trimethoxyphenyl)methylideneamino]piperidine-4-carboxamide
Also Known As: 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide, 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(2,4,5-trimethoxyphenyl)methylideneamino]piperidine-4-carboxamide, 1-(2-chloro-4-fluorobenzyl)-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]piperidine-4-carbohydrazide, N-[(1E)-2-(2,4,5-trimethoxyphenyl)-1-azavinyl]{1-[(2-chloro-4-fluorophenyl)met hyl](4-piperidyl)}carboxamide
| Molecular Formula | C23H27ClFN3O4 |
|---|---|
| Molecular Weight | 463.17 g/mol |
| LogP | 3.8672 |
| Topological Polar Surface Area | 72.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 463.16742 |
| Heavy Atoms | 32 |
| Complexity | 977.9541 |
Chemical Identifiers
| CAS Number | 444931-48-0 |
|---|---|
| SMILES | COC1=CC(=C(C=C1/C=N/NC(=O)C2CCN(CC2)CC3=C(C=C(C=C3)F)Cl)OC)OC |
Product Overview
1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide (CAS 444931-48-0), with molecular formula C23H27ClFN3O4 and molecular weight 463.17 g/mol. IUPAC: 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-(2,4,5-trimethoxyphenyl)methylideneamino]piperidine-4-carboxamide.
Chemical Property Profile of 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide
Property Insights of 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide
The XLogP value of 3.8672 indicates that 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide. Following Lipinski's Rule of Five, 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide has 1 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 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide?
The CAS number of 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide is 444931-48-0.
What is the molecular formula of 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide?
The molecular formula of 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide is C23H27ClFN3O4.
What is the molecular weight of 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide?
The molecular weight of 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide is 463.17 g/mol.
Where can I buy 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide?
You can request a quote for 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide 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-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-chloro-4-fluorobenzyl)-N'-(2,4,5-trimethoxybenzylidene)-4-piperidinecarbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.