Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate
TL;DR: Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate (CAS 302909-59-7) is a chemical compound with molecular formula C15H21NO3 and molecular weight 263.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(4-tert-butylbenzoyl)amino]acetate
Also Known As: ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate, Ethyl 2-(4-(tert-butyl)benzamido)acetate, ethylbutylbenzoylaminoacetate, ethyl 2-[(4-tert-butylphenyl)formamido]acetate, ethyl 2-[(4-tert-butylbenzoyl)amino]acetate
| Molecular Formula | C15H21NO3 |
|---|---|
| Molecular Weight | 263.15 g/mol |
| LogP | 2.277 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.15213 |
| Heavy Atoms | 19 |
| Complexity | 443.45364 |
Chemical Identifiers
| CAS Number | 302909-59-7 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)C1=CC=C(C=C1)C(C)(C)C |
Product Overview
Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate (CAS 302909-59-7), with molecular formula C15H21NO3 and molecular weight 263.15 g/mol. IUPAC: ethyl 2-[(4-tert-butylbenzoyl)amino]acetate.
Chemical Property Profile of Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate
Property Insights of Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate
The XLogP value of 2.277 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-{[4-(tert-butyl)benzoyl]amino}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 Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate?
The CAS number of Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate is 302909-59-7.
What is the molecular formula of Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate?
The molecular formula of Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate is C15H21NO3.
What is the molecular weight of Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate?
The molecular weight of Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate is 263.15 g/mol.
Where can I buy Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate?
You can request a quote for Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-{[4-(tert-butyl)benzoyl]amino}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.