Sulfaflavine
TL;DR: Sulfaflavine (CAS 2391-30-2) is a chemical compound with molecular formula C19H14N2O5S and molecular weight 382.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-2-(4-methylphenyl)-1,3-dioxobenzo[de]isoquinoline-5-sulfonic acid
Also Known As: Sulfaflavine, Sulfoflavin FF, Acid Yellow 7, Brilliant Sulfa Flavine, C.I. Acid Yellow 7
| Molecular Formula | C19H14N2O5S |
|---|---|
| Molecular Weight | 382.06 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 382.06235 |
| Heavy Atoms | 27 |
| Complexity | 725.0 |
Chemical Identifiers
| CAS Number | 2391-30-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3=CC=CC4=C3C(=CC(=C4N)S(=O)(=O)O)C2=O |
| InChIKey | NISZMWZPLJGKCC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sulfaflavine (CAS 2391-30-2), with molecular formula C19H14N2O5S and molecular weight 382.06 g/mol. IUPAC: 6-amino-2-(4-methylphenyl)-1,3-dioxobenzo[de]isoquinoline-5-sulfonic acid.
Chemical Property Profile of Sulfaflavine
Property Insights of Sulfaflavine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sulfaflavine. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sulfaflavine. Following Lipinski's Rule of Five, Sulfaflavine has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Sulfaflavine?
The CAS number of Sulfaflavine is 2391-30-2.
What is the molecular formula of Sulfaflavine?
The molecular formula of Sulfaflavine is C19H14N2O5S.
What is the molecular weight of Sulfaflavine?
The molecular weight of Sulfaflavine is 382.06 g/mol.
Where can I buy Sulfaflavine?
You can request a quote for Sulfaflavine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfaflavine?
Yes, KEHONG BIO provides custom synthesis services for Sulfaflavine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.