2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) structure

2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)

TL;DR: 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) (CAS 2183-66-6) is a chemical compound with molecular formula C24H38I3N3O10 and molecular weight 908.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol

Also Known As: 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1), 2-{3,5-Bis[(ethylimino)(hydroxy)methyl]-2,4,6-triiodophenoxy}pentanoic acid--1-deoxy-1-(methylamino)hexitol (1/1), Valeric acid, 2-(3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy)-, compd. with 1-deoxy-1-(methylamino)-D-glucitol (1:1), 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid; (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol, 2-{3,5-Bis[(ethylimino)(hydroxy)methyl]-2,4,6-triiodophenoxy}pentanoic acid--1-deoxy-1-(methylamino)-D-glucitol (1/1)

CAS: 2183-66-6
Molecular Formula C24H38I3N3O10
Molecular Weight 908.97 g/mol
LogP 0.2736
Topological Polar Surface Area 218.0 Ų
Hydrogen Bond Donors 9
Hydrogen Bond Acceptors 11
Rotatable Bonds 15
Exact Mass 908.9691
Heavy Atoms 40
Complexity 639.0

Chemical Identifiers

CAS Number 2183-66-6
SMILES CCCC(C(=O)O)OC1=C(C(=C(C(=C1I)C(=O)NCC)I)C(=O)NCC)I.CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O
InChIKey DUNXOMHWVPHBJV-WZTVWXICSA-N

Product Overview

2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) (CAS 2183-66-6), with molecular formula C24H38I3N3O10 and molecular weight 908.97 g/mol. IUPAC: 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol.

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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-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)

XLogP
0.2736
TPSA (Topological Polar Surface Area)
218.0
Hydrogen Bond Donors
9
Hydrogen Bond Acceptors
11
Rotatable Bonds
15
Heavy Atoms
40
Complexity
639.0
Exact Mass
908.9691
Monoisotopic Mass
908.9691
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-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)

The XLogP value of 0.2736 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1). The TPSA of 218.0 Ų indicates high polarity, suggesting 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) has 9 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

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-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)?

The CAS number of 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) is 2183-66-6.

What is the molecular formula of 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)?

The molecular formula of 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) is C24H38I3N3O10.

What is the molecular weight of 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)?

The molecular weight of 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) is 908.97 g/mol.

Where can I buy 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)?

You can request a quote for 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)?

Yes, KEHONG BIO provides custom synthesis services for 2-[3,5-bis(ethylcarbamoyl)-2,4,6-triiodophenoxy]pentanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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