RefChem:434827
TL;DR: RefChem:434827 (CAS 68399-89-3) is a chemical compound with molecular formula C24H21N3O14S4 and molecular weight 702.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-acetamido-4-hydroxy-3-[[1-sulfo-6-(2-sulfooxyethylsulfonyl)naphthalen-2-yl]diazenyl]naphthalene-2-sulfonic acid
Also Known As: 1-Naphthalenesulfonic acid, 2-[[6-(acetylamino)-1-hydroxy-3-sulfo-2-naphthalenyl]azo]-6-[[2-(sulfooxy)ethyl]sulfonyl]-, 1-Naphthalenesulfonic acid, 2-((6-(acetylamino)-1-hydroxy-3-sulfo-2-naphthalenyl)azo)-6-((2-(sulfooxy)ethyl)sulfonyl)-, 1-Naphthalenesulfonic acid, 2-(2-(6-(acetylamino)-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl)-6-((2-(sulfooxy)ethyl)sulfonyl)-, (3Z)-7-acetamido-4-oxo-3-[[1-sulfo-6-(2-sulfooxyethylsulfonyl)naphthalen-2-yl]hydrazinylidene]naphthalene-2-sulfonic acid, 1-Naphthalenesulfonic acid, 2-[2-[6-(acetylamino)-1-hydroxy-3-sulfo-2-naphthalenyl]diazenyl]-6-[[2-(sulfooxy)ethyl]sulfonyl]-
| Molecular Formula | C24H21N3O14S4 |
|---|---|
| Molecular Weight | 702.99 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 314.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 10 |
| Exact Mass | 702.99066 |
| Heavy Atoms | 45 |
| Complexity | 1540.0 |
Chemical Identifiers
| CAS Number | 68399-89-3 |
|---|---|
| SMILES | CC(=O)NC1=CC2=CC(=C(C(=C2C=C1)O)N=NC3=C(C4=C(C=C3)C=C(C=C4)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O |
| InChIKey | GKTYMBPDFIBFLS-UHFFFAOYSA-N |
Product Overview
RefChem:434827 (CAS 68399-89-3), with molecular formula C24H21N3O14S4 and molecular weight 702.99 g/mol. IUPAC: 7-acetamido-4-hydroxy-3-[[1-sulfo-6-(2-sulfooxyethylsulfonyl)naphthalen-2-yl]diazenyl]naphthalene-2-sulfonic acid.
Chemical Property Profile of RefChem:434827
Property Insights of RefChem:434827
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:434827. The TPSA of 314.0 Ų indicates high polarity, suggesting RefChem:434827 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:434827 has 5 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 RefChem:434827?
The CAS number of RefChem:434827 is 68399-89-3.
What is the molecular formula of RefChem:434827?
The molecular formula of RefChem:434827 is C24H21N3O14S4.
What is the molecular weight of RefChem:434827?
The molecular weight of RefChem:434827 is 702.99 g/mol.
Where can I buy RefChem:434827?
You can request a quote for RefChem:434827 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:434827?
Yes, KEHONG BIO provides custom synthesis services for RefChem:434827 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.