[2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate
TL;DR: [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate (CAS 727981-36-4) is a chemical compound with molecular formula C20H23NO5 and molecular weight 357.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,4-dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate
Also Known As: AB00609748-02, [(2,4-DIMETHOXYPHENYL)CARBAMOYL]METHYL 2-PHENYLBUTANOATE, [2-(2,4-dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate, 2-((2,4-dimethoxyphenyl)amino)-2-oxoethyl 2-phenylbutanoate, F6609-3330
| Molecular Formula | C20H23NO5 |
|---|---|
| Molecular Weight | 357.16 g/mol |
| LogP | 3.3793 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 357.15762 |
| Heavy Atoms | 26 |
| Complexity | 745.1217 |
Chemical Identifiers
| CAS Number | 727981-36-4 |
|---|---|
| SMILES | CCC(C1=CC=CC=C1)C(=O)OCC(=O)NC2=C(C=C(C=C2)OC)OC |
Product Overview
[2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate (CAS 727981-36-4), with molecular formula C20H23NO5 and molecular weight 357.16 g/mol. IUPAC: [2-(2,4-dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate.
Chemical Property Profile of [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate
Property Insights of [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate
The XLogP value of 3.3793 indicates that [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate. Following Lipinski's Rule of Five, [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate has 1 hydrogen bond donor(s) and 5 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 [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate?
The CAS number of [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate is 727981-36-4.
What is the molecular formula of [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate?
The molecular formula of [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate is C20H23NO5.
What is the molecular weight of [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate?
The molecular weight of [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate is 357.16 g/mol.
Where can I buy [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate?
You can request a quote for [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(2,4-Dimethoxyanilino)-2-oxoethyl] 2-phenylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.