Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate
TL;DR: Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate (CAS 355147-05-6) is a chemical compound with molecular formula C17H13F4NO4 and molecular weight 371.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3,3,3-trifluoro-2-[4-[(3-fluorobenzoyl)amino]phenyl]-2-hydroxypropanoate
Also Known As: (R)-methyl 3,3,3-trifluoro-2-(4-(3-fluorobenzamido)phenyl)-2-hydroxypropanoate, methyl 3,3,3-trifluoro-2-(4-{[(3-fluorophenyl)carbonyl]amino}phenyl)-2-hydroxypropanoate, methyl 3,3,3-trifluoro-2-[4-[(3-fluorobenzoyl)amino]phenyl]-2-hydroxypropanoate, METHYL 3,3,3-TRIFLUORO-2-{4-[(3-FLUOROBENZOYL)AMINO]PHENYL}-2-HYDROXYPROPANOATE
| Molecular Formula | C17H13F4NO4 |
|---|---|
| Molecular Weight | 371.08 g/mol |
| LogP | 3.0009 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.07806 |
| Heavy Atoms | 26 |
| Complexity | 820.25775 |
Chemical Identifiers
| CAS Number | 355147-05-6 |
|---|---|
| SMILES | COC(=O)C(C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)F)(C(F)(F)F)O |
Product Overview
Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate (CAS 355147-05-6), with molecular formula C17H13F4NO4 and molecular weight 371.08 g/mol. IUPAC: methyl 3,3,3-trifluoro-2-[4-[(3-fluorobenzoyl)amino]phenyl]-2-hydroxypropanoate.
Chemical Property Profile of Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate
Property Insights of Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate
The XLogP value of 3.0009 indicates that Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate. Following Lipinski's Rule of Five, Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate 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 Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate?
The CAS number of Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate is 355147-05-6.
What is the molecular formula of Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate?
The molecular formula of Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate is C17H13F4NO4.
What is the molecular weight of Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate?
The molecular weight of Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate is 371.08 g/mol.
Where can I buy Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate?
You can request a quote for Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3,3,3-trifluoro-2-{4-[(3-fluorobenzoyl)amino]phenyl}-2-hydroxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.