(E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
TL;DR: (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide (CAS 577982-81-1) is a chemical compound with molecular formula C27H32N6O3 and molecular weight 488.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-N-heptylpyrrolo[3,2-b]quinoxaline-3-carboxamide
Also Known As: (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide, 2-amino-1-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-N-heptylpyrrolo[3,2-b]quinoxaline-3-carboxamide, 2-amino-1-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
| Molecular Formula | C27H32N6O3 |
|---|---|
| Molecular Weight | 488.25 g/mol |
| LogP | 4.7663 |
| Topological Polar Surface Area | 116.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 488.2536 |
| Heavy Atoms | 36 |
| Complexity | 1395.5496 |
Chemical Identifiers
| CAS Number | 577982-81-1 |
|---|---|
| SMILES | CCCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)/N=C/C4=C(C(=CC=C4)OC)OC)N |
Product Overview
(E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide (CAS 577982-81-1), with molecular formula C27H32N6O3 and molecular weight 488.25 g/mol. IUPAC: 2-amino-1-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-N-heptylpyrrolo[3,2-b]quinoxaline-3-carboxamide.
Chemical Property Profile of (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Property Insights of (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
The XLogP value of 4.7663 indicates that (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.65 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide. Following Lipinski's Rule of Five, (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide has 2 hydrogen bond donor(s) and 7 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 (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The CAS number of (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is 577982-81-1.
What is the molecular formula of (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The molecular formula of (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is C27H32N6O3.
What is the molecular weight of (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The molecular weight of (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is 488.25 g/mol.
Where can I buy (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
You can request a quote for (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-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-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-amino-1-((2,3-dimethoxybenzylidene)amino)-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.