Flavin semiquinone
TL;DR: Flavin semiquinone (CAS 35919-91-6) is a chemical compound with molecular formula C17H19N4O6- and molecular weight 375.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,8-dimethyl-4-oxo-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridin-2-olate
Also Known As: Fad semiquinone, flavin semiquinone, Riboflavin semiquinone, Riboflavine semiquinone, Riboflavin, radical ion(1-)
| Molecular Formula | C17H19N4O6- |
|---|---|
| Molecular Weight | 375.13 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.13046 |
| Heavy Atoms | 27 |
| Complexity | 693.0 |
Chemical Identifiers
| CAS Number | 35919-91-6 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N(C3=NC(=NC(=O)C3=N2)[O-])CC(C(C(CO)O)O)O |
| InChIKey | AUNGANRZJHBGPY-UHFFFAOYSA-M |
Product Overview
Flavin semiquinone (CAS 35919-91-6), with molecular formula C17H19N4O6- and molecular weight 375.13 g/mol. IUPAC: 7,8-dimethyl-4-oxo-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridin-2-olate.
Chemical Property Profile of Flavin semiquinone
Property Insights of Flavin semiquinone
The XLogP value of -0.5 indicates that Flavin semiquinone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 161.0 Ų indicates high polarity, suggesting Flavin semiquinone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Flavin semiquinone has 4 hydrogen bond donor(s) and 7 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 Flavin semiquinone?
The CAS number of Flavin semiquinone is 35919-91-6.
What is the molecular formula of Flavin semiquinone?
The molecular formula of Flavin semiquinone is C17H19N4O6-.
What is the molecular weight of Flavin semiquinone?
The molecular weight of Flavin semiquinone is 375.13 g/mol.
Where can I buy Flavin semiquinone?
You can request a quote for Flavin semiquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Flavin semiquinone?
Yes, KEHONG BIO provides custom synthesis services for Flavin semiquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.