RefChem:261731
TL;DR: RefChem:261731 (CAS 65104-29-2) is a chemical compound with molecular formula C26H20N6O7S and molecular weight 560.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-5-[[4-[[4-[(3-sulfophenyl)diazenyl]phenyl]carbamoylamino]phenyl]diazenyl]benzoic acid
Also Known As: Benzoic acid, 2-hydroxy-5-((4-((((4-((3-sulfophenyl)azo)phenyl)amino)carbonyl)amino)phenyl)azo)-, Benzoic acid, 2-hydroxy-5-[[4-[[[[4-[(3-sulfophenyl)azo]phenyl]amino]carbonyl]amino]phenyl]azo]-, Benzoic acid, 2-hydroxy-5-(2-(4-((((4-(2-(3-sulfophenyl)diazenyl)phenyl)amino)carbonyl)amino)phenyl)diazenyl)-, (3E)-6-oxo-3-[[4-[[4-[(3-sulfophenyl)diazenyl]phenyl]carbamoylamino]phenyl]hydrazinylidene]cyclohexa-1,4-diene-1-carboxylic acid, (3Z)-6-oxo-3-[[4-[[4-[(3-sulfophenyl)diazenyl]phenyl]carbamoylamino]phenyl]hydrazinylidene]cyclohexa-1,4-diene-1-carboxylic acid
| Molecular Formula | C26H20N6O7S |
|---|---|
| Molecular Weight | 560.11 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 211.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 560.1114 |
| Heavy Atoms | 40 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 65104-29-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)O)N=NC2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)N=NC4=CC(=C(C=C4)O)C(=O)O |
| InChIKey | ICMQGTVSMIBIDB-UHFFFAOYSA-N |
Product Overview
RefChem:261731 (CAS 65104-29-2), with molecular formula C26H20N6O7S and molecular weight 560.11 g/mol. IUPAC: 2-hydroxy-5-[[4-[[4-[(3-sulfophenyl)diazenyl]phenyl]carbamoylamino]phenyl]diazenyl]benzoic acid.
Chemical Property Profile of RefChem:261731
Property Insights of RefChem:261731
The XLogP value of 4.5 indicates that RefChem:261731 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 211.0 Ų indicates high polarity, suggesting RefChem:261731 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:261731 has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:261731?
The CAS number of RefChem:261731 is 65104-29-2.
What is the molecular formula of RefChem:261731?
The molecular formula of RefChem:261731 is C26H20N6O7S.
What is the molecular weight of RefChem:261731?
The molecular weight of RefChem:261731 is 560.11 g/mol.
Where can I buy RefChem:261731?
You can request a quote for RefChem:261731 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:261731?
Yes, KEHONG BIO provides custom synthesis services for RefChem:261731 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.