2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide structure

2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

TL;DR: 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide (CAS 840511-08-2) is a chemical compound with molecular formula C27H24N6O and molecular weight 448.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Also Known As: 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide, (E)-2-amino-1-(benzylideneamino)-N-(3-phenylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide, 2-amino-1-{[(E)-phenylmethylidene]amino}-N-(3-phenylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

CAS: 840511-08-2
Molecular Formula C27H24N6O
Molecular Weight 448.20 g/mol
LogP 4.4115
Topological Polar Surface Area 98.19 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 448.20117
Heavy Atoms 34
Complexity 1475.3752

Chemical Identifiers

CAS Number 840511-08-2
SMILES C1=CC=C(C=C1)CCCNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)/N=C/C5=CC=CC=C5)N

Product Overview

2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide (CAS 840511-08-2), with molecular formula C27H24N6O and molecular weight 448.20 g/mol. IUPAC: 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide.

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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 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

XLogP
4.4115
TPSA (Topological Polar Surface Area)
98.19
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
7
Heavy Atoms
34
Complexity
1475.3752
Exact Mass
448.20117
Monoisotopic Mass
448.20117
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 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

The XLogP value of 4.4115 indicates that 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-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 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide. Following Lipinski's Rule of Five, 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide has 2 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 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide?

The CAS number of 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide is 840511-08-2.

What is the molecular formula of 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide?

The molecular formula of 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide is C27H24N6O.

What is the molecular weight of 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide?

The molecular weight of 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide is 448.20 g/mol.

Where can I buy 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide?

You can request a quote for 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-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 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide?

Yes, KEHONG BIO provides custom synthesis services for 2-amino-1-[(E)-benzylideneamino]-N-(3-phenylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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