2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate
TL;DR: 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate (CAS 815658-44-7) is a chemical compound with molecular formula C26H26N2O4 and molecular weight 430.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylethyl 4-[2-(benzylcarbamoyl)anilino]-4-oxobutanoate
Also Known As: phenethyl 4-[2-(benzylcarbamoyl)anilino]-4-oxobutanoate, 2-phenylethyl 4-({2-[(benzylamino)carbonyl]phenyl}amino)-4-oxobutanoate, Phenethyl 3-[[2-(benzylcarbamoyl)phenyl]carbamoyl]propanoate, 2-phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate
| Molecular Formula | C26H26N2O4 |
|---|---|
| Molecular Weight | 430.19 g/mol |
| LogP | 4.1212 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 430.18927 |
| Heavy Atoms | 32 |
| Complexity | 1035.9622 |
Chemical Identifiers
| CAS Number | 815658-44-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCOC(=O)CCC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3 |
Product Overview
2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate (CAS 815658-44-7), with molecular formula C26H26N2O4 and molecular weight 430.19 g/mol. IUPAC: 2-phenylethyl 4-[2-(benzylcarbamoyl)anilino]-4-oxobutanoate.
Chemical Property Profile of 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate
Property Insights of 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate
The XLogP value of 4.1212 indicates that 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate. Following Lipinski's Rule of Five, 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate has 2 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 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate?
The CAS number of 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate is 815658-44-7.
What is the molecular formula of 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate?
The molecular formula of 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate is C26H26N2O4.
What is the molecular weight of 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate?
The molecular weight of 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate is 430.19 g/mol.
Where can I buy 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate?
You can request a quote for 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]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-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenylethyl 4-{[2-(benzylcarbamoyl)phenyl]amino}-4-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.