Blue flavin
TL;DR: Blue flavin (CAS 86189-63-1) is a chemical compound with molecular formula C13H12N4O2S and molecular weight 288.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,8,10-trimethyl-2-sulfinylbenzo[g]pteridin-4-one
Also Known As: Blue flavin, Flavin 2-S-oxide, 7,8,10-trimethyl-2-sulfinylbenzo[g]pteridin-4-one, Benzo(g)pteridin-4(3H)-one, 2,10-dihydro-7,8,10-trimethyl-2-sulfinyl-, 7,8,10-Trimethyl-2-(oxo-lambda~4~-sulfanylidene)-2,10-dihydrobenzo[g]pteridin-4(3H)-one
| Molecular Formula | C13H12N4O2S |
|---|---|
| Molecular Weight | 288.07 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 75.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 288.06808 |
| Heavy Atoms | 20 |
| Complexity | 579.0 |
Chemical Identifiers
| CAS Number | 86189-63-1 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N(C3=NC(=S=O)NC(=O)C3=N2)C |
| InChIKey | IXYGPUFAQIGWQJ-UHFFFAOYSA-N |
Product Overview
Blue flavin (CAS 86189-63-1), with molecular formula C13H12N4O2S and molecular weight 288.07 g/mol. IUPAC: 7,8,10-trimethyl-2-sulfinylbenzo[g]pteridin-4-one.
Chemical Property Profile of Blue flavin
Property Insights of Blue flavin
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Blue flavin. The TPSA of 75.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Blue flavin. Following Lipinski's Rule of Five, Blue flavin has 1 hydrogen bond donor(s) and 4 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 Blue flavin?
The CAS number of Blue flavin is 86189-63-1.
What is the molecular formula of Blue flavin?
The molecular formula of Blue flavin is C13H12N4O2S.
What is the molecular weight of Blue flavin?
The molecular weight of Blue flavin is 288.07 g/mol.
Where can I buy Blue flavin?
You can request a quote for Blue flavin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Blue flavin?
Yes, KEHONG BIO provides custom synthesis services for Blue flavin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.