![Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate structure](/static/products/654/65437-82-3.png)
Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate
TL;DR: Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate (CAS 65437-82-3) is a chemical compound with molecular formula C18H17ClFNO3 and molecular weight 349.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2S)-2-(N-benzoyl-3-chloro-4-fluoroanilino)propanoate
Also Known As: J1.617.292H, ethyl (2S)-2-(N-benzoyl-3-chloro-4-fluoroanilino)propanoate, ETHYL (2S)-2-[BENZOYL-(3-CHLORO-4-FLUORO-PHENYL)AMINO]PROPANOATE, Ethyl N-benzoyl-N-(3-chloro-4-fluorophenyl)alaninate, Ethyl N-benzoyl-N-(3-chloro-4-fluorophenyl)-L-alaninate
| Molecular Formula | C18H17ClFNO3 |
|---|---|
| Molecular Weight | 349.09 g/mol |
| LogP | 4.0775 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.0881 |
| Heavy Atoms | 24 |
| Complexity | 736.29865 |
Chemical Identifiers
| CAS Number | 65437-82-3 |
|---|---|
| SMILES | CCOC(=O)[C@H](C)N(C1=CC(=C(C=C1)F)Cl)C(=O)C2=CC=CC=C2 |
Product Overview
Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate (CAS 65437-82-3), with molecular formula C18H17ClFNO3 and molecular weight 349.09 g/mol. IUPAC: ethyl (2S)-2-(N-benzoyl-3-chloro-4-fluoroanilino)propanoate.
Chemical Property Profile of Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate
Property Insights of Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate
The XLogP value of 4.0775 indicates that Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate has 0 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 (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate?
The CAS number of Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate is 65437-82-3.
What is the molecular formula of Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate?
The molecular formula of Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate is C18H17ClFNO3.
What is the molecular weight of Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate?
The molecular weight of Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate is 349.09 g/mol.
Where can I buy Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate?
You can request a quote for Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (2S)-2-[benzoyl-(3-chloro-4-fluoro-phenyl)amino]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.