2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate
TL;DR: 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate (CAS 433693-28-8) is a chemical compound with molecular formula C25H29NO4 and molecular weight 407.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-cyclohexylphenyl)-2-oxoethyl] 4-(3-methylanilino)-4-oxobutanoate
Also Known As: 2-(4-cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate, AJ-292/41206364, [2-(4-cyclohexylphenyl)-2-oxoethyl] 4-(3-methylanilino)-4-oxobutanoate
| Molecular Formula | C25H29NO4 |
|---|---|
| Molecular Weight | 407.21 g/mol |
| LogP | 5.18752 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 407.20966 |
| Heavy Atoms | 30 |
| Complexity | 882.27655 |
Chemical Identifiers
| CAS Number | 433693-28-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)CCC(=O)OCC(=O)C2=CC=C(C=C2)C3CCCCC3 |
Product Overview
2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate (CAS 433693-28-8), with molecular formula C25H29NO4 and molecular weight 407.21 g/mol. IUPAC: [2-(4-cyclohexylphenyl)-2-oxoethyl] 4-(3-methylanilino)-4-oxobutanoate.
Chemical Property Profile of 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate
Property Insights of 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate
The XLogP value of 5.18752 indicates that 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate. Following Lipinski's Rule of Five, 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate has 1 hydrogen bond donor(s) and 4 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-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate?
The CAS number of 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate is 433693-28-8.
What is the molecular formula of 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate?
The molecular formula of 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate is C25H29NO4.
What is the molecular weight of 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate?
The molecular weight of 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate is 407.21 g/mol.
Where can I buy 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate?
You can request a quote for 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Cyclohexylphenyl)-2-oxoethyl 4-oxo-4-(3-toluidino)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.