Benfluorex, (S)-
TL;DR: Benfluorex, (S)- (CAS 1333167-90-0) is a chemical compound with molecular formula C19H20F3NO2 and molecular weight 351.14462 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[(2S)-1-[3-(trifluoromethyl)phenyl]propan-2-yl]amino]ethyl benzoate
Also Known As: benfluorex, Benfluorex, (S)-, (S)-benfluorex, CAS-23642-66-2, Ethanol, 2-(((1S)-1-methyl-2-(3-(trifluoromethyl)phenyl)ethyl)amino)-, 1-benzoate
Technical Specifications
| Molecular Formula | C19H20F3NO2 |
| Molecular Weight | 351.14462 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 351.14462 Da |
| Heavy Atoms | 25 |
| Complexity | 408.0 |
| SMILES | C[C@@H](CC1=CC(=CC=C1)C(F)(F)F)NCCOC(=O)C2=CC=CC=C2 |
| InChIKey | CJAVTWRYCDNHSM-AWEZNQCLSA-N |
Chemical Property Profile of Benfluorex, (S)-
Property Insights of Benfluorex, (S)-
The XLogP value of 4.6 indicates that Benfluorex, (S)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Benfluorex, (S)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benfluorex, (S)- has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benfluorex, (S)-?
The CAS number of Benfluorex, (S)- is 1333167-90-0.
What is the molecular formula of Benfluorex, (S)-?
The molecular formula of Benfluorex, (S)- is C19H20F3NO2.
What is the molecular weight of Benfluorex, (S)-?
The molecular weight of Benfluorex, (S)- is 351.14462 g/mol.
Where can I buy Benfluorex, (S)-?
You can request a quote for Benfluorex, (S)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benfluorex, (S)-?
Yes, CoreyChem provides custom synthesis services for Benfluorex, (S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.