7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine
TL;DR: 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine (CAS 3452-74-2) is a chemical compound with molecular formula C17H17F3N4O6 and molecular weight 430.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-10-(2,3,4,5-tetrahydroxypentyl)-8-(trifluoromethyl)benzo[g]pteridine-2,4-dione
Also Known As: 7-M-8-Tfmriaz, Riboflavin, alpha8,alpha8,alpha8-trifluoro-, 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine, 7-methyl-10-(2,3,4,5-tetrahydroxypentyl)-8-(trifluoromethyl)benzo[g]pteridine-2,4-dione, 1-deoxy-1-[7-methyl-2,4-dioxo-8-(trifluoromethyl)-3,4-dihydrobenzo[g]pteridin-10(2h)-yl]pentitol
| Molecular Formula | C17H17F3N4O6 |
|---|---|
| Molecular Weight | 430.11 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 430.11002 |
| Heavy Atoms | 30 |
| Complexity | 773.0 |
Chemical Identifiers
| CAS Number | 3452-74-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C(F)(F)F)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(CO)O)O)O |
| InChIKey | NWQZPIAZGILWSQ-UHFFFAOYSA-N |
Product Overview
7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine (CAS 3452-74-2), with molecular formula C17H17F3N4O6 and molecular weight 430.11 g/mol. IUPAC: 7-methyl-10-(2,3,4,5-tetrahydroxypentyl)-8-(trifluoromethyl)benzo[g]pteridine-2,4-dione.
Chemical Property Profile of 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine
Property Insights of 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine
The XLogP value of -0.9 indicates that 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 155.0 Ų indicates high polarity, suggesting 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine has 5 hydrogen bond donor(s) and 10 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 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine?
The CAS number of 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine is 3452-74-2.
What is the molecular formula of 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine?
The molecular formula of 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine is C17H17F3N4O6.
What is the molecular weight of 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine?
The molecular weight of 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine is 430.11 g/mol.
Where can I buy 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine?
You can request a quote for 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine?
Yes, KEHONG BIO provides custom synthesis services for 7-Methyl-8-trifluoromethyl-10-(1'-D-ribityl)isoalloxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.