![[3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate structure](/static/products/6553/65533-30-4.webp)
[3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate
TL;DR: [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate (CAS 65533-30-4) is a chemical compound with molecular formula C30H25N3O8S2 and molecular weight 619.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate
Also Known As: [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate|6-(Methylsulfanyl)-5-sulfanylidene-2-(2,3,5-tri-O-benzoylpentofuranosyl)-4,5-dihydro-1,2,4-triazin-3(2H)-one
| Molecular Formula | C30H25N3O8S2 |
|---|---|
| Molecular Weight | 619.11 g/mol |
| LogP | 4.22839 |
| Topological Polar Surface Area | 138.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 619.10834 |
| Heavy Atoms | 43 |
| Complexity | 1714.3832 |
Chemical Identifiers
| CAS Number | 65533-30-4 |
|---|---|
| SMILES | CSC1=NN(C(=O)NC1=S)C2C(C(C(O2)COC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5 |
Product Overview
[3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate (CAS 65533-30-4), with molecular formula C30H25N3O8S2 and molecular weight 619.11 g/mol. IUPAC: [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate.
Chemical Property Profile of [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate
Property Insights of [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate
The XLogP value of 4.22839 indicates that [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.81 Ų falls within the moderate polarity range, balancing permeability and solubility for [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate. Following Lipinski's Rule of Five, [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate?
The CAS number of [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate is 65533-30-4.
What is the molecular formula of [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate?
The molecular formula of [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate is C30H25N3O8S2.
What is the molecular weight of [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate?
The molecular weight of [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate is 619.11 g/mol.
Where can I buy [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate?
You can request a quote for [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate?
Yes, KEHONG BIO provides custom synthesis services for [3,4-dibenzoyloxy-5-(6-methylsulfanyl-3-oxo-5-sulfanylidene-1,2,4-triazin-2-yl)oxolan-2-yl]methyl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.