hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate structure

hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate

TL;DR: hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate (CAS 577696-49-2) is a chemical compound with molecular formula C21H28N4O2 and molecular weight 368.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

hexyl 2-amino-1-(2-methylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Also Known As: hexyl 2-amino-1-(2-methylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate, hexyl 2-amino-1-isobutyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate, hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate

CAS: 577696-49-2
Molecular Formula C21H28N4O2
Molecular Weight 368.22 g/mol
LogP 4.5598
Topological Polar Surface Area 83.03 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 8
Exact Mass 368.22122
Heavy Atoms 27
Complexity 946.15027

Chemical Identifiers

CAS Number 577696-49-2
SMILES CCCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC(C)C)N

Product Overview

hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate (CAS 577696-49-2), with molecular formula C21H28N4O2 and molecular weight 368.22 g/mol. IUPAC: hexyl 2-amino-1-(2-methylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate

XLogP
4.5598
TPSA (Topological Polar Surface Area)
83.03
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
8
Heavy Atoms
27
Complexity
946.15027
Exact Mass
368.22122
Monoisotopic Mass
368.22122
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate

The XLogP value of 4.5598 indicates that hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.03 Ų falls within the moderate polarity range, balancing permeability and solubility for hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate. Following Lipinski's Rule of Five, hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?

The CAS number of hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is 577696-49-2.

What is the molecular formula of hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?

The molecular formula of hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is C21H28N4O2.

What is the molecular weight of hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?

The molecular weight of hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is 368.22 g/mol.

Where can I buy hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?

You can request a quote for hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?

Yes, KEHONG BIO provides custom synthesis services for hexyl 2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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