![(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate structure](/static/products/4594/459422-16-3.webp)
(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate
TL;DR: (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate (CAS 459422-16-3) is a chemical compound with molecular formula C15H10FN3O3 and molecular weight 299.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-fluorobenzoate
Also Known As: (4-oxo-3,4-dihydro-1,2,3-benzotriazin-3-yl)methyl 2-fluorobenzoate, (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-fluorobenzoate, (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate, F0624-0035
| Molecular Formula | C15H10FN3O3 |
|---|---|
| Molecular Weight | 299.07 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 71.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.07062 |
| Heavy Atoms | 22 |
| Complexity | 471.0 |
Chemical Identifiers
| CAS Number | 459422-16-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=CC=CC=C3F |
| InChIKey | OPVLUIZUNFGXDN-UHFFFAOYSA-N |
Product Overview
(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate (CAS 459422-16-3), with molecular formula C15H10FN3O3 and molecular weight 299.07 g/mol. IUPAC: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-fluorobenzoate.
Chemical Property Profile of (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate
Property Insights of (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate
The XLogP value of 3.3 indicates that (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate. Following Lipinski's Rule of Five, (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate has 0 hydrogen bond donor(s) and 6 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 (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate?
The CAS number of (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate is 459422-16-3.
What is the molecular formula of (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate?
The molecular formula of (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate is C15H10FN3O3.
What is the molecular weight of (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate?
The molecular weight of (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate is 299.07 g/mol.
Where can I buy (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate?
You can request a quote for (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 2-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.