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Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate
TL;DR: Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate (CAS 667410-53-9) is a chemical compound with molecular formula C20H23NO3 and molecular weight 325.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[(4-tert-butylbenzoyl)amino]phenyl]acetate
Also Known As: methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate, methyl 2-[4-[(4-tert-butylbenzoyl)amino]phenyl]acetate, methyl (4-{[(4-tert-butylphenyl)carbonyl]amino}phenyl)acetate, methyl 2-(4-(4-(tert-butyl)benzamido)phenyl)acetate, 2-[4-[(4-tert-butylbenzoyl)amino]phenyl]acetic acid methyl ester
| Molecular Formula | C20H23NO3 |
|---|---|
| Molecular Weight | 325.17 g/mol |
| LogP | 3.9519 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 325.1678 |
| Heavy Atoms | 24 |
| Complexity | 710.0443 |
Chemical Identifiers
| CAS Number | 667410-53-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)CC(=O)OC |
Product Overview
Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate (CAS 667410-53-9), with molecular formula C20H23NO3 and molecular weight 325.17 g/mol. IUPAC: methyl 2-[4-[(4-tert-butylbenzoyl)amino]phenyl]acetate.
Chemical Property Profile of Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate
Property Insights of Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate
The XLogP value of 3.9519 indicates that Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate has 1 hydrogen bond donor(s) and 3 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 Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate?
The CAS number of Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate is 667410-53-9.
What is the molecular formula of Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate?
The molecular formula of Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate is C20H23NO3.
What is the molecular weight of Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate?
The molecular weight of Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate is 325.17 g/mol.
Where can I buy Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate?
You can request a quote for Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl {4-[(4-tert-butylbenzoyl)amino]phenyl}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.