RefChem:73081
TL;DR: RefChem:73081 (CAS 72927-91-4) is a chemical compound with molecular formula C22H15ClN7Na3O10S3 and molecular weight 736.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;2-[[4-chloro-6-[2-methoxy-4-[(3-sulfonatophenyl)diazenyl]anilino]-1,3,5-triazin-2-yl]amino]benzene-1,4-disulfonate
Also Known As: 1,4-Benzenedisulfonic acid, 2-((4-chloro-6-((2-methoxy-4-((3-sulfophenyl)azo)phenyl)amino)-1,3,5-triazin-2-yl)amino)-, trisodium salt, 1,4-Benzenedisulfonic acid, 2-((4-chloro-6-((2-methoxy-4-((3-sulfophenyl)azo)phenyl)amino)-s-triazin-2-yl)amino)-, trisodium salt, 1,4-Benzenedisulfonic acid, 2-((4-chloro-6-((2-methoxy-4-(2-(3-sulfophenyl)diazenyl)phenyl)amino)-1,3,5-triazin-2-yl)amino)-, sodium salt (1:3), 1,4-Benzenedisulfonic acid, 2-[[4-chloro-6-[[2-methoxy-4-[(3-sulfophenyl)azo]phenyl]amino]-1,3,5-triazin-2-yl]amino]-, trisodium salt, 1,4-Benzenedisulfonic acid, 2-[[4-chloro-6-[[2-methoxy-4-[2-(3-sulfophenyl)diazenyl]phenyl]amino]-1,3,5-triazin-2-yl]amino]-, sodium salt (1:3)
| Molecular Formula | C22H15ClN7Na3O10S3 |
|---|---|
| Molecular Weight | 736.94 g/mol |
| LogP | -5.8395 |
| Topological Polar Surface Area | 293.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 7 |
| Exact Mass | 736.94244 |
| Heavy Atoms | 46 |
| Complexity | 1250.0 |
Chemical Identifiers
| CAS Number | 72927-91-4 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)[O-])NC3=NC(=NC(=N3)Cl)NC4=C(C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+] |
| InChIKey | FIFKTDSXJNRBOT-UHFFFAOYSA-K |
Product Overview
RefChem:73081 (CAS 72927-91-4), with molecular formula C22H15ClN7Na3O10S3 and molecular weight 736.94 g/mol. IUPAC: trisodium;2-[[4-chloro-6-[2-methoxy-4-[(3-sulfonatophenyl)diazenyl]anilino]-1,3,5-triazin-2-yl]amino]benzene-1,4-disulfonate.
Chemical Property Profile of RefChem:73081
Property Insights of RefChem:73081
The XLogP value of -5.8395 indicates that RefChem:73081 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 293.0 Ų indicates high polarity, suggesting RefChem:73081 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:73081 has 2 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:73081?
The CAS number of RefChem:73081 is 72927-91-4.
What is the molecular formula of RefChem:73081?
The molecular formula of RefChem:73081 is C22H15ClN7Na3O10S3.
What is the molecular weight of RefChem:73081?
The molecular weight of RefChem:73081 is 736.94 g/mol.
Where can I buy RefChem:73081?
You can request a quote for RefChem:73081 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:73081?
Yes, KEHONG BIO provides custom synthesis services for RefChem:73081 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.