![(E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide structure](/static/products/836/836651-55-9.png)
(E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
TL;DR: (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide (CAS 836651-55-9) is a chemical compound with molecular formula C28H25FN6O4 and molecular weight 528.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-N-[(4-fluorophenyl)methyl]-1-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide
Also Known As: (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide, 2-amino-N-(4-fluorobenzyl)-1-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide, 2-amino-N-[(4-fluorophenyl)methyl]-1-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide
| Molecular Formula | C28H25FN6O4 |
|---|---|
| Molecular Weight | 528.19 g/mol |
| LogP | 4.1438 |
| Topological Polar Surface Area | 125.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 528.19214 |
| Heavy Atoms | 39 |
| Complexity | 1690.6323 |
Chemical Identifiers
| CAS Number | 836651-55-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)/C=N/N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC=C(C=C5)F)N |
Product Overview
(E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide (CAS 836651-55-9), with molecular formula C28H25FN6O4 and molecular weight 528.19 g/mol. IUPAC: 2-amino-N-[(4-fluorophenyl)methyl]-1-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide.
Chemical Property Profile of (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Property Insights of (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
The XLogP value of 4.1438 indicates that (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.88 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide. Following Lipinski's Rule of Five, (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The CAS number of (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is 836651-55-9.
What is the molecular formula of (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The molecular formula of (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is C28H25FN6O4.
What is the molecular weight of (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The molecular weight of (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is 528.19 g/mol.
Where can I buy (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
You can request a quote for (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-amino-N-(4-fluorobenzyl)-1-((3,4,5-trimethoxybenzylidene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.