RefChem:476683
TL;DR: RefChem:476683 (CAS 68189-25-3) is a chemical compound with molecular formula C40H26BaN4O8S2 and molecular weight 892.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
barium(2+);bis(1-[(2-hydroxynaphthalen-1-yl)diazenyl]naphthalene-2-sulfonate)
Also Known As: C20H14N2O4S.1/2Ba, C20-H14-N2-O4-S.1/2Ba, 1-((2-Hydroxy-1-naphthalenyl)azo)-2-naphthalenesulfonic acid, barium salt (2:1), 2-Naphthalenesulfonic acid, 1-((2-hydroxy-1-naphthalenyl)azo)-, barium salt (2:1), 2-Naphthalenesulfonic acid, 1-(2-(2-hydroxy-1-naphthalenyl)diazenyl)-, barium salt (2:1)
| Molecular Formula | C40H26BaN4O8S2 |
|---|---|
| Molecular Weight | 892.02 g/mol |
| LogP | 9.66 |
| Topological Polar Surface Area | 221.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 892.0245 |
| Heavy Atoms | 55 |
| Complexity | 634.0 |
Chemical Identifiers
| CAS Number | 68189-25-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC4=CC=CC=C43)S(=O)(=O)[O-])O.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC4=CC=CC=C43)S(=O)(=O)[O-])O.[Ba+2] |
| InChIKey | WZSYFWCUSRJEEQ-UHFFFAOYSA-L |
Product Overview
RefChem:476683 (CAS 68189-25-3), with molecular formula C40H26BaN4O8S2 and molecular weight 892.02 g/mol. IUPAC: barium(2+);bis(1-[(2-hydroxynaphthalen-1-yl)diazenyl]naphthalene-2-sulfonate).
Chemical Property Profile of RefChem:476683
Property Insights of RefChem:476683
The XLogP value of 9.66 indicates that RefChem:476683 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 221.0 Ų indicates high polarity, suggesting RefChem:476683 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:476683 has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:476683?
The CAS number of RefChem:476683 is 68189-25-3.
What is the molecular formula of RefChem:476683?
The molecular formula of RefChem:476683 is C40H26BaN4O8S2.
What is the molecular weight of RefChem:476683?
The molecular weight of RefChem:476683 is 892.02 g/mol.
Where can I buy RefChem:476683?
You can request a quote for RefChem:476683 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:476683?
Yes, KEHONG BIO provides custom synthesis services for RefChem:476683 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.