RefChem:1073282
TL;DR: RefChem:1073282 (CAS 63680-64-8) is a chemical compound with molecular formula C17H19N3O11S and molecular weight 473.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-hydroxy-7-[[2-hydroxy-2-(4-nitrophenyl)acetyl]amino]quinoline-5-sulfonic acid;trihydrate
Also Known As: 5-Quinolinesulfonic acid, 8-hydroxy-7-((beta-hydroxy-p-nitro-alpha-oxo)phenethylamino)-, trihydrate, 8-hydroxy-7-{[hydroxy(4-nitrophenyl)acetyl]amino}quinoline-5-sulfonic acid trihydrate, 8-Hydroxy-7-(2-hydroxy-2-(4-nitrophenyl)acetamido)quinoline-5-sulfonic acid trihydrate, 8-hydroxy-7-[[2-hydroxy-2-(4-nitrophenyl)acetyl]amino]quinoline-5-sulfonic Acid Trihydrate, 5-Quinolinesulfonic acid, 8-hydroxy-7-[[hydroxy(4-nitrophenyl)acetyl]amino]-, trihydrate
| Molecular Formula | C17H19N3O11S |
|---|---|
| Molecular Weight | 473.07 g/mol |
| LogP | -0.71 |
| Topological Polar Surface Area | 194.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 473.07404 |
| Heavy Atoms | 32 |
| Complexity | 713.0 |
Chemical Identifiers
| CAS Number | 63680-64-8 |
|---|---|
| SMILES | C1=CC2=C(C=C(C(=C2N=C1)O)NC(=O)C(C3=CC=C(C=C3)[N+](=O)[O-])O)S(=O)(=O)O.O.O.O |
| InChIKey | YMOHQCIVLNQJJA-UHFFFAOYSA-N |
Product Overview
RefChem:1073282 (CAS 63680-64-8), with molecular formula C17H19N3O11S and molecular weight 473.07 g/mol. IUPAC: 8-hydroxy-7-[[2-hydroxy-2-(4-nitrophenyl)acetyl]amino]quinoline-5-sulfonic acid;trihydrate.
Chemical Property Profile of RefChem:1073282
Property Insights of RefChem:1073282
The XLogP value of -0.71 indicates that RefChem:1073282 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 194.0 Ų indicates high polarity, suggesting RefChem:1073282 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1073282 has 7 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:1073282?
The CAS number of RefChem:1073282 is 63680-64-8.
What is the molecular formula of RefChem:1073282?
The molecular formula of RefChem:1073282 is C17H19N3O11S.
What is the molecular weight of RefChem:1073282?
The molecular weight of RefChem:1073282 is 473.07 g/mol.
Where can I buy RefChem:1073282?
You can request a quote for RefChem:1073282 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1073282?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1073282 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.