3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt
TL;DR: 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt (CAS 55425-27-9) is a chemical compound with molecular formula C21H21N2NaO6S2Se2 and molecular weight 643.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium 3-[(2E)-2-[[3-(3-sulfonatopropyl)-1,3-benzoselenazol-3-ium-2-yl]methylidene]-1,3-benzoselenazol-3-yl]propane-1-sulfonate
Also Known As: 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt, Benzoselenazolium, 3-(3-sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)-, inner salt, sodium salt, Benzoselenazolium, 3-(3-sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)-, inner salt, sodium salt (1:1), sodium 3-[(2E)-2-[[3-(3-sulfonatopropyl)-1,3-benzoselenazol-3-ium-2-yl]methylidene]-1,3-benzoselenazol-3-yl]propane-1-sulfonate
| Molecular Formula | C21H21N2NaO6S2Se2 |
|---|---|
| Molecular Weight | 643.91 g/mol |
| LogP | -2.793 |
| Topological Polar Surface Area | 121.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 643.9069 |
| Heavy Atoms | 34 |
| Complexity | 1424.0413 |
Chemical Identifiers
| CAS Number | 55425-27-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N(/C(=C\C3=[N+](C4=CC=CC=C4[Se]3)CCCS(=O)(=O)[O-])/[Se]2)CCCS(=O)(=O)[O-].[Na+] |
Product Overview
3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt (CAS 55425-27-9), with molecular formula C21H21N2NaO6S2Se2 and molecular weight 643.91 g/mol. IUPAC: sodium 3-[(2E)-2-[[3-(3-sulfonatopropyl)-1,3-benzoselenazol-3-ium-2-yl]methylidene]-1,3-benzoselenazol-3-yl]propane-1-sulfonate.
Chemical Property Profile of 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt
Property Insights of 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt
The XLogP value of -2.793 indicates that 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 121.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt. Following Lipinski's Rule of Five, 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt?
The CAS number of 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt is 55425-27-9.
What is the molecular formula of 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt?
The molecular formula of 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt is C21H21N2NaO6S2Se2.
What is the molecular weight of 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt?
The molecular weight of 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt is 643.91 g/mol.
Where can I buy 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt?
You can request a quote for 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Sulfopropyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)benzoselenazolium, hydroxide, inner salt, sodium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.