![[2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate structure](/static/products/4136/413609-66-2.webp)
[2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate
TL;DR: [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate (CAS 413609-66-2) is a chemical compound with molecular formula C21H13Br2ClFNO3 and molecular weight 538.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2,4-dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate
Also Known As: 2,4-dibromo-6-{[(2-chlorobenzoyl)amino]methyl}phenyl 4-fluorobenzoate, [2,4-dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate
| Molecular Formula | C21H13Br2ClFNO3 |
|---|---|
| Molecular Weight | 538.89 g/mol |
| LogP | 6.1533 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 538.8935 |
| Heavy Atoms | 29 |
| Complexity | 1074.0214 |
Chemical Identifiers
| CAS Number | 413609-66-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NCC2=C(C(=CC(=C2)Br)Br)OC(=O)C3=CC=C(C=C3)F)Cl |
Product Overview
[2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate (CAS 413609-66-2), with molecular formula C21H13Br2ClFNO3 and molecular weight 538.89 g/mol. IUPAC: [2,4-dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate.
Chemical Property Profile of [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate
Property Insights of [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate
The XLogP value of 6.1533 indicates that [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate?
The CAS number of [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate is 413609-66-2.
What is the molecular formula of [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate?
The molecular formula of [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate is C21H13Br2ClFNO3.
What is the molecular weight of [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate?
The molecular weight of [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate is 538.89 g/mol.
Where can I buy [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate?
You can request a quote for [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2,4-Dibromo-6-[[(2-chlorobenzoyl)amino]methyl]phenyl] 4-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.