3-Methylriboflavin
TL;DR: 3-Methylriboflavin (CAS 28721-76-8) is a chemical compound with molecular formula C18H22N4O6 and molecular weight 390.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7,8-trimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4-dione
Also Known As: 3-Methylriboflavin, Riboflavin, 3-methyl-, 3-METHYL-7,8-DIMETHYL-10-(1'-D-RIBITYL)ISOALLOXAZINE, 3,7,8-Trimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)isoalloxazine, 1-Deoxy-1-(3,7,8-trimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol
| Molecular Formula | C18H22N4O6 |
|---|---|
| Molecular Weight | 390.15 g/mol |
| LogP | -1.71316 |
| Topological Polar Surface Area | 150.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.15393 |
| Heavy Atoms | 28 |
| Complexity | 1121.7267 |
Chemical Identifiers
| CAS Number | 28721-76-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N(C3=NC(=O)N(C(=O)C3=N2)C)C[C@@H]([C@@H]([C@@H](CO)O)O)O |
Product Overview
3-Methylriboflavin (CAS 28721-76-8), with molecular formula C18H22N4O6 and molecular weight 390.15 g/mol. IUPAC: 3,7,8-trimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4-dione.
Chemical Property Profile of 3-Methylriboflavin
Property Insights of 3-Methylriboflavin
The XLogP value of -1.71316 indicates that 3-Methylriboflavin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 150.7 Ų indicates high polarity, suggesting 3-Methylriboflavin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-Methylriboflavin has 4 hydrogen bond donor(s) and 8 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 3-Methylriboflavin?
The CAS number of 3-Methylriboflavin is 28721-76-8.
What is the molecular formula of 3-Methylriboflavin?
The molecular formula of 3-Methylriboflavin is C18H22N4O6.
What is the molecular weight of 3-Methylriboflavin?
The molecular weight of 3-Methylriboflavin is 390.15 g/mol.
Where can I buy 3-Methylriboflavin?
You can request a quote for 3-Methylriboflavin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylriboflavin?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylriboflavin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.