trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate
TL;DR: trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate (CAS 73398-81-9) is a chemical compound with molecular formula C28H16N7Na3O12S3 and molecular weight 806.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate
Also Known As: 2H-Naphtho[1,2-d]triazole-5-sulfonic acid, 2-[4-[2-[4-[(hexahydro-2,4,6-trioxo-5-pyrimidinyl)azo]-2-sulfophenyl]ethenyl]-3-sulfophenyl]-, trisodium salt, 2H-Naphtho[1,2-d]triazole-5-sulfonic acid, 2-[4-[2-[4-[2-(hexahydro-2,4,6-trioxo-5-pyrimidinyl)diazenyl]-2-sulfophenyl]ethenyl]-3-sulfophenyl]-, sodium salt (1:3), Trisodium 2-[3-sulfonato-4-(2-{2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl}ethen-1-yl)phenyl]-2H-naphtho[1,2-d][1,2,3]triazole-5-sulfonate, trisodium,2-[3-sulfonato-4-[(E)-2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate
| Molecular Formula | C28H16N7Na3O12S3 |
|---|---|
| Molecular Weight | 806.97 g/mol |
| LogP | -7.7133 |
| Topological Polar Surface Area | 327.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 5 |
| Exact Mass | 806.9712 |
| Heavy Atoms | 53 |
| Complexity | 1680.0 |
Chemical Identifiers
| CAS Number | 73398-81-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC3=NN(N=C23)C4=CC(=C(C=C4)C=CC5=C(C=C(C=C5)N=NC6C(=O)NC(=O)NC6=O)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+] |
| InChIKey | AMPKWFMDRHLIFQ-UHFFFAOYSA-K |
Product Overview
trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate (CAS 73398-81-9), with molecular formula C28H16N7Na3O12S3 and molecular weight 806.97 g/mol. IUPAC: trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate.
Chemical Property Profile of trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate
Property Insights of trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate
The XLogP value of -7.7133 indicates that trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 327.0 Ų indicates high polarity, suggesting trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate has 2 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate?
The CAS number of trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate is 73398-81-9.
What is the molecular formula of trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate?
The molecular formula of trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate is C28H16N7Na3O12S3.
What is the molecular weight of trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate?
The molecular weight of trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate is 806.97 g/mol.
Where can I buy trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate?
You can request a quote for trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for trisodium;2-[3-sulfonato-4-[2-[2-sulfonato-4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]ethenyl]phenyl]benzo[e]benzotriazole-5-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.