![(E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide structure](/static/products/577/577990-48-8.png)
(E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
TL;DR: (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide (CAS 577990-48-8) is a chemical compound with molecular formula C23H17ClN6OS and molecular weight 460.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-[(E)-(3-chlorophenyl)methylideneamino]-N-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide
Also Known As: (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide, 2-amino-1-[(E)-(3-chlorophenyl)methylideneamino]-N-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide, 2-amino-1-{[(E)-(3-chlorophenyl)methylidene]amino}-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
| Molecular Formula | C23H17ClN6OS |
|---|---|
| Molecular Weight | 460.09 g/mol |
| LogP | 4.6938 |
| Topological Polar Surface Area | 98.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 460.0873 |
| Heavy Atoms | 32 |
| Complexity | 1475.2108 |
Chemical Identifiers
| CAS Number | 577990-48-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C3C(=C(N(C3=N2)/N=C/C4=CC(=CC=C4)Cl)N)C(=O)NCC5=CC=CS5 |
Product Overview
(E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide (CAS 577990-48-8), with molecular formula C23H17ClN6OS and molecular weight 460.09 g/mol. IUPAC: 2-amino-1-[(E)-(3-chlorophenyl)methylideneamino]-N-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide.
Chemical Property Profile of (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Property Insights of (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
The XLogP value of 4.6938 indicates that (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.19 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide. Following Lipinski's Rule of Five, (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide has 2 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 (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The CAS number of (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is 577990-48-8.
What is the molecular formula of (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The molecular formula of (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is C23H17ClN6OS.
What is the molecular weight of (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The molecular weight of (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is 460.09 g/mol.
Where can I buy (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
You can request a quote for (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-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-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-amino-1-((3-chlorobenzylidene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.