N(3)-Methyltetraacetylriboflavin
TL;DR: N(3)-Methyltetraacetylriboflavin (CAS 83481-39-4) is a chemical compound with molecular formula C26H32N4O10 and molecular weight 560.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2,3,4-triacetyloxy-5-(3,7,8-trimethyl-2,4-dioxo-1,5-dihydrobenzo[g]pteridin-10-yl)pentyl] acetate
Also Known As: MTAAR, N(3)-Methyltetraacetylriboflavin, N(3)-Methyl-2',3',4',5'-tetraacetylriboflavin, Riboflavin, 1,5-dihydro-3-methyl-, 2',3',4',5'-tetraacetate, [2,3,4-triacetyloxy-5-(3,7,8-trimethyl-2,4-dioxo-1,5-dihydrobenzo[g]pteridin-10-yl)pentyl] acetate
| Molecular Formula | C26H32N4O10 |
|---|---|
| Molecular Weight | 560.21 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 170.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 13 |
| Exact Mass | 560.21185 |
| Heavy Atoms | 40 |
| Complexity | 1090.0 |
Chemical Identifiers
| CAS Number | 83481-39-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N(C3=C(N2)C(=O)N(C(=O)N3)C)CC(C(C(COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | SJXWZFZDQGUPNF-UHFFFAOYSA-N |
Product Overview
N(3)-Methyltetraacetylriboflavin (CAS 83481-39-4), with molecular formula C26H32N4O10 and molecular weight 560.21 g/mol. IUPAC: [2,3,4-triacetyloxy-5-(3,7,8-trimethyl-2,4-dioxo-1,5-dihydrobenzo[g]pteridin-10-yl)pentyl] acetate.
Chemical Property Profile of N(3)-Methyltetraacetylriboflavin
Property Insights of N(3)-Methyltetraacetylriboflavin
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N(3)-Methyltetraacetylriboflavin. The TPSA of 170.0 Ų indicates high polarity, suggesting N(3)-Methyltetraacetylriboflavin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N(3)-Methyltetraacetylriboflavin has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N(3)-Methyltetraacetylriboflavin?
The CAS number of N(3)-Methyltetraacetylriboflavin is 83481-39-4.
What is the molecular formula of N(3)-Methyltetraacetylriboflavin?
The molecular formula of N(3)-Methyltetraacetylriboflavin is C26H32N4O10.
What is the molecular weight of N(3)-Methyltetraacetylriboflavin?
The molecular weight of N(3)-Methyltetraacetylriboflavin is 560.21 g/mol.
Where can I buy N(3)-Methyltetraacetylriboflavin?
You can request a quote for N(3)-Methyltetraacetylriboflavin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N(3)-Methyltetraacetylriboflavin?
Yes, KEHONG BIO provides custom synthesis services for N(3)-Methyltetraacetylriboflavin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.