![2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) structure](/static/products/2184/21846-27-5.webp)
2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)
TL;DR: 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) (CAS 21846-27-5) 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.
(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol;2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid
Also Known As: 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1), 2-{3,5-Bis[hydroxy(methylimino)methyl]-2,4,6-triiodophenoxy}heptanoic acid--1-deoxy-1-(methylamino)hexitol (1/1), Heptanoic acid, 2-(3,5-bis(methylcarbamoyl)-2,4,6-triiodophenoxy)-, compd. with 1-deoxy-1-(methylamino)-D-glucitol (1:1), (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol; 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid, 2-{3,5-Bis[hydroxy(methylimino)methyl]-2,4,6-triiodophenoxy}heptanoic acid--1-deoxy-1-(methylamino)-D-glucitol (1/1)
| 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 | 641.0 |
Chemical Identifiers
| CAS Number | 21846-27-5 |
|---|---|
| SMILES | CCCCCC(C(=O)O)OC1=C(C(=C(C(=C1I)C(=O)NC)I)C(=O)NC)I.CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O |
| InChIKey | GWLGGPGKQNVHJL-WZTVWXICSA-N |
Product Overview
2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) (CAS 21846-27-5), with molecular formula C24H38I3N3O10 and molecular weight 908.97 g/mol. IUPAC: (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol;2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid.
Chemical Property Profile of 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)
Property Insights of 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic 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-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1). The TPSA of 218.0 Ų indicates high polarity, suggesting 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic 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-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic 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
Frequently Asked Questions
What is the CAS number of 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)?
The CAS number of 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) is 21846-27-5.
What is the molecular formula of 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)?
The molecular formula of 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) is C24H38I3N3O10.
What is the molecular weight of 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)?
The molecular weight of 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) is 908.97 g/mol.
Where can I buy 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)?
You can request a quote for 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic 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-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1)?
Yes, KEHONG BIO provides custom synthesis services for 2-[2,4,6-triiodo-3,5-bis(methylcarbamoyl)phenoxy]heptanoic acid- 1-deoxy-1-(methylamino)-d-glucitol(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.