RefChem:576339
TL;DR: RefChem:576339 (CAS 69943-64-2) is a chemical compound with molecular formula C36H28CrN8NaO12S2 and molecular weight 903.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium;chromium(3+);bis(8-(methoxycarbonylamino)-1-[(2-oxido-5-sulfamoylphenyl)diazenyl]naphthalen-2-olate)
Also Known As: Chromate(1-), bis(methyl (8-((5-(aminosulfonyl)-2-(hydroxy-kappaO)phenyl)azo-kappaN1)-7-(hydroxy-kappaO)-1-naphthalenyl)carbamato(2-))-, sodium, Chromate(1-), bis(methyl N-(8-(2-(5-(aminosulfonyl)-2-(hydroxy-kappaO)phenyl)diazenyl-kappaN1)-7-(hydroxy-kappaO)-1-naphthalenyl)carbamato(2-))-, sodium (1:1), Chromate(1-), bis(N-(8-((5-(aminosulfonyl)-2-hydroxyphenyl)azo)-7-hydroxy-1-naphthalenyl)(methoxycarbonyl)amidato(2-))-, sodium salt, Chromate(1-), bis[methyl [8-[[5-(aminosulfonyl)-2-(hydroxy-.kappa.O)phenyl]azo-.kappa.N1]-7-(hydroxy-.kappa.O)-1-naphthalenyl]carbamato(2-)]-, sodium, Chromate(1-), bis[methyl [8-[[5-(aminosulfonyl)-2-hydroxyphenyl]azo]-7-hydroxy-1-naphthalenyl]carbamato(2-)]-, sodium
| Molecular Formula | C36H28CrN8NaO12S2 |
|---|---|
| Molecular Weight | 903.06 g/mol |
| LogP | 1.4577 |
| Topological Polar Surface Area | 355.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 10 |
| Exact Mass | 903.05707 |
| Heavy Atoms | 60 |
| Complexity | 712.0 |
Chemical Identifiers
| CAS Number | 69943-64-2 |
|---|---|
| SMILES | COC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)N)[O-].COC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)N)[O-].[Na+].[Cr+3] |
| InChIKey | QDFMXYNTFMQDHB-UHFFFAOYSA-J |
Product Overview
RefChem:576339 (CAS 69943-64-2), with molecular formula C36H28CrN8NaO12S2 and molecular weight 903.06 g/mol. IUPAC: sodium;chromium(3+);bis(8-(methoxycarbonylamino)-1-[(2-oxido-5-sulfamoylphenyl)diazenyl]naphthalen-2-olate).
Chemical Property Profile of RefChem:576339
Property Insights of RefChem:576339
The XLogP value of 1.4577 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:576339. The TPSA of 355.0 Ų indicates high polarity, suggesting RefChem:576339 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:576339 has 4 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:576339?
The CAS number of RefChem:576339 is 69943-64-2.
What is the molecular formula of RefChem:576339?
The molecular formula of RefChem:576339 is C36H28CrN8NaO12S2.
What is the molecular weight of RefChem:576339?
The molecular weight of RefChem:576339 is 903.06 g/mol.
Where can I buy RefChem:576339?
You can request a quote for RefChem:576339 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:576339?
Yes, KEHONG BIO provides custom synthesis services for RefChem:576339 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.