Phenacyl 4-(2-methylanilino)-4-oxobutanoate
TL;DR: Phenacyl 4-(2-methylanilino)-4-oxobutanoate (CAS 352218-95-2) is a chemical compound with molecular formula C19H19NO4 and molecular weight 325.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenacyl 4-(2-methylanilino)-4-oxobutanoate
Also Known As: phenacyl 4-(2-methylanilino)-4-oxobutanoate, 2-oxo-2-phenylethyl 4-oxo-4-(2-toluidino)butanoate, 2-oxo-2-phenylethyl 3-[N-(2-methylphenyl)carbamoyl]propanoate, 2-oxo-2-phenylethyl 4-[(2-methylphenyl)amino]-4-oxobutanoate
| Molecular Formula | C19H19NO4 |
|---|---|
| Molecular Weight | 325.13 g/mol |
| LogP | 3.13982 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 325.1314 |
| Heavy Atoms | 24 |
| Complexity | 725.1565 |
Chemical Identifiers
| CAS Number | 352218-95-2 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)CCC(=O)OCC(=O)C2=CC=CC=C2 |
Product Overview
Phenacyl 4-(2-methylanilino)-4-oxobutanoate (CAS 352218-95-2), with molecular formula C19H19NO4 and molecular weight 325.13 g/mol. IUPAC: phenacyl 4-(2-methylanilino)-4-oxobutanoate.
Chemical Property Profile of Phenacyl 4-(2-methylanilino)-4-oxobutanoate
Property Insights of Phenacyl 4-(2-methylanilino)-4-oxobutanoate
The XLogP value of 3.13982 indicates that Phenacyl 4-(2-methylanilino)-4-oxobutanoate 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 Phenacyl 4-(2-methylanilino)-4-oxobutanoate. Following Lipinski's Rule of Five, Phenacyl 4-(2-methylanilino)-4-oxobutanoate has 1 hydrogen bond donor(s) and 4 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 Phenacyl 4-(2-methylanilino)-4-oxobutanoate?
The CAS number of Phenacyl 4-(2-methylanilino)-4-oxobutanoate is 352218-95-2.
What is the molecular formula of Phenacyl 4-(2-methylanilino)-4-oxobutanoate?
The molecular formula of Phenacyl 4-(2-methylanilino)-4-oxobutanoate is C19H19NO4.
What is the molecular weight of Phenacyl 4-(2-methylanilino)-4-oxobutanoate?
The molecular weight of Phenacyl 4-(2-methylanilino)-4-oxobutanoate is 325.13 g/mol.
Where can I buy Phenacyl 4-(2-methylanilino)-4-oxobutanoate?
You can request a quote for Phenacyl 4-(2-methylanilino)-4-oxobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenacyl 4-(2-methylanilino)-4-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Phenacyl 4-(2-methylanilino)-4-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.