N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide
TL;DR: N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide (CAS 514818-69-0) is a chemical compound with molecular formula C32H31N5O3 and molecular weight 533.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide
Also Known As: N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide, N'-{3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxybenzylidene}-2-(4-ethoxyphenyl)-4-quinolinecarbohydrazide, N'-[(E)-{3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]-2-(4-ethoxyphenyl)quinoline-4-carbohydrazide, N-((1E)-2-{3-[(3,5-dimethylpyrazolyl)methyl]-4-methoxyphenyl}-1-azavinyl)[2-(4 -ethoxyphenyl)(4-quinolyl)]carboxamide
| Molecular Formula | C32H31N5O3 |
|---|---|
| Molecular Weight | 533.24 g/mol |
| LogP | 5.93464 |
| Topological Polar Surface Area | 90.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 533.2427 |
| Heavy Atoms | 40 |
| Complexity | 1689.4546 |
Chemical Identifiers
| CAS Number | 514818-69-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N/N=C/C4=CC(=C(C=C4)OC)CN5C(=CC(=N5)C)C |
Product Overview
N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide (CAS 514818-69-0), with molecular formula C32H31N5O3 and molecular weight 533.24 g/mol. IUPAC: N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide.
Chemical Property Profile of N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide
Property Insights of N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide
The XLogP value of 5.93464 indicates that N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide. Following Lipinski's Rule of Five, N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide?
The CAS number of N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide is 514818-69-0.
What is the molecular formula of N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide?
The molecular formula of N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide is C32H31N5O3.
What is the molecular weight of N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide?
The molecular weight of N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide is 533.24 g/mol.
Where can I buy N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide?
You can request a quote for N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(E)-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.