Isoriboflavin
TL;DR: Isoriboflavin (CAS 6633-24-5) is a chemical compound with molecular formula C17H20N4O6 and molecular weight 376.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dimethyl-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4-dione
Also Known As: Isoriboflavin, Isoriboflavine, Riboflavin, 8-demethyl-6-methyl-, Riboflavine, 8-demethyl-6-methyl-, X 18
| Molecular Formula | C17H20N4O6 |
|---|---|
| Molecular Weight | 376.14 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.13828 |
| Heavy Atoms | 27 |
| Complexity | 680.0 |
Chemical Identifiers
| CAS Number | 6633-24-5 |
|---|---|
| SMILES | CC1=C(C2=C(C=C1)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(CO)O)O)O)C |
| InChIKey | LXMDIEJPPQSFFB-UHFFFAOYSA-N |
Product Overview
Isoriboflavin (CAS 6633-24-5), with molecular formula C17H20N4O6 and molecular weight 376.14 g/mol. IUPAC: 6,7-dimethyl-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4-dione.
Chemical Property Profile of Isoriboflavin
Property Insights of Isoriboflavin
The XLogP value of -1.5 indicates that Isoriboflavin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 155.0 Ų indicates high polarity, suggesting Isoriboflavin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Isoriboflavin has 5 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 Isoriboflavin?
The CAS number of Isoriboflavin is 6633-24-5.
What is the molecular formula of Isoriboflavin?
The molecular formula of Isoriboflavin is C17H20N4O6.
What is the molecular weight of Isoriboflavin?
The molecular weight of Isoriboflavin is 376.14 g/mol.
Where can I buy Isoriboflavin?
You can request a quote for Isoriboflavin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoriboflavin?
Yes, KEHONG BIO provides custom synthesis services for Isoriboflavin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.