2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate
TL;DR: 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate (CAS 516467-41-7) is a chemical compound with molecular formula C27H27NO5 and molecular weight 445.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl] 4-(2-methoxyanilino)-4-oxobutanoate
Also Known As: 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate, [2-(3,4-dimethylphenyl)-2-oxo-1-phenyl-ethyl] 3-[(2-methoxyphenyl)carbamoyl]propanoate, [2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl] 4-(2-methoxyanilino)-4-oxobutanoate, 2-(3,4-DIMETHYLPHENYL)-2-OXO-1-PHENYLETHYL 4-(2-METHOXYANILINO)-4-OXOBUTANOATE, 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-[(2-methoxyphenyl)amino]-4-oxobutanoate
| Molecular Formula | C27H27NO5 |
|---|---|
| Molecular Weight | 445.19 g/mol |
| LogP | 5.19814 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 445.18893 |
| Heavy Atoms | 33 |
| Complexity | 1140.2584 |
Chemical Identifiers
| CAS Number | 516467-41-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)C(C2=CC=CC=C2)OC(=O)CCC(=O)NC3=CC=CC=C3OC)C |
Product Overview
2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate (CAS 516467-41-7), with molecular formula C27H27NO5 and molecular weight 445.19 g/mol. IUPAC: [2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl] 4-(2-methoxyanilino)-4-oxobutanoate.
Chemical Property Profile of 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate
Property Insights of 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate
The XLogP value of 5.19814 indicates that 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate. Following Lipinski's Rule of Five, 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate?
The CAS number of 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate is 516467-41-7.
What is the molecular formula of 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate?
The molecular formula of 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate is C27H27NO5.
What is the molecular weight of 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate?
The molecular weight of 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate is 445.19 g/mol.
Where can I buy 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate?
You can request a quote for 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl 4-((2-methoxyphenyl)amino)-4-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.