![[1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate structure](/static/products/819/819856-85-4.png)
[1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate
TL;DR: [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate (CAS 819856-85-4) is a chemical compound with molecular formula C19H20ClNO6 and molecular weight 393.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(2-chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate
Also Known As: [1-(2-chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate|[(2R)-1-(2-chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate
| Molecular Formula | C19H20ClNO6 |
|---|---|
| Molecular Weight | 393.10 g/mol |
| LogP | 3.5498 |
| Topological Polar Surface Area | 83.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 393.0979 |
| Heavy Atoms | 27 |
| Complexity | 813.69476 |
Chemical Identifiers
| CAS Number | 819856-85-4 |
|---|---|
| SMILES | CC(C(=O)NC1=CC=CC=C1Cl)OC(=O)C2=CC(=C(C(=C2)OC)OC)OC |
Product Overview
[1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate (CAS 819856-85-4), with molecular formula C19H20ClNO6 and molecular weight 393.10 g/mol. IUPAC: [1-(2-chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate.
Chemical Property Profile of [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate
Property Insights of [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate
The XLogP value of 3.5498 indicates that [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate 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 [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate. Following Lipinski's Rule of Five, [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate 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 [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate?
The CAS number of [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate is 819856-85-4.
What is the molecular formula of [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate?
The molecular formula of [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate is C19H20ClNO6.
What is the molecular weight of [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate?
The molecular weight of [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate is 393.10 g/mol.
Where can I buy [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate?
You can request a quote for [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for [1-(2-Chloroanilino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.