![Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate structure](/static/products/4591/459152-38-6.webp)
Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate
TL;DR: Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate (CAS 459152-38-6) is a chemical compound with molecular formula C20H22BrNO6 and molecular weight 451.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate
Also Known As: propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate, AE-641/40795575, PROPYL 4-(2-BROMO-3,4,5-TRIMETHOXYBENZAMIDO)BENZOATE, propyl 4-[(2-bromo-3,4,5-trimethoxyphenyl)carbonylamino]benzoate
| Molecular Formula | C20H22BrNO6 |
|---|---|
| Molecular Weight | 451.06 g/mol |
| LogP | 4.294 |
| Topological Polar Surface Area | 83.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 451.06305 |
| Heavy Atoms | 28 |
| Complexity | 850.7647 |
Chemical Identifiers
| CAS Number | 459152-38-6 |
|---|---|
| SMILES | CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C(=C2Br)OC)OC)OC |
Product Overview
Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate (CAS 459152-38-6), with molecular formula C20H22BrNO6 and molecular weight 451.06 g/mol. IUPAC: propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate.
Chemical Property Profile of Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate
Property Insights of Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate
The XLogP value of 4.294 indicates that Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.09 Ų falls within the moderate polarity range, balancing permeability and solubility for Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate. Following Lipinski's Rule of Five, Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate has 1 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 Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate?
The CAS number of Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate is 459152-38-6.
What is the molecular formula of Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate?
The molecular formula of Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate is C20H22BrNO6.
What is the molecular weight of Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate?
The molecular weight of Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate is 451.06 g/mol.
Where can I buy Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate?
You can request a quote for Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Propyl 4-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.