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Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate
TL;DR: Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate (CAS 351497-68-2) is a chemical compound with molecular formula C24H14F3NO5 and molecular weight 453.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate
Also Known As: phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate, 2-oxo-2-phenylethyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]-5-isoindolinecarboxylate, 2-oxo-2-phenylethyl 1,3-dioxo-2-(3-(trifluoromethyl)phenyl)isoindoline-5-carboxylate, 2-oxo-2-phenylethyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]benzo[c]azoline-5-c arboxylate, 2-oxo-2-phenylethyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindole-5-carboxylate
| Molecular Formula | C24H14F3NO5 |
|---|---|
| Molecular Weight | 453.08 g/mol |
| LogP | 4.5457 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.0824 |
| Heavy Atoms | 33 |
| Complexity | 1284.7572 |
Chemical Identifiers
| CAS Number | 351497-68-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC(=C4)C(F)(F)F |
Product Overview
Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate (CAS 351497-68-2), with molecular formula C24H14F3NO5 and molecular weight 453.08 g/mol. IUPAC: phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate.
Chemical Property Profile of Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate
Property Insights of Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate
The XLogP value of 4.5457 indicates that Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.75 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate. Following Lipinski's Rule of Five, Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate has 0 hydrogen bond donor(s) and 5 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 Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate?
The CAS number of Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate is 351497-68-2.
What is the molecular formula of Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate?
The molecular formula of Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate is C24H14F3NO5.
What is the molecular weight of Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate?
The molecular weight of Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate is 453.08 g/mol.
Where can I buy Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate?
You can request a quote for Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Phenacyl 1,3-dioxo-2-[3-(trifluoromethyl)phenyl]isoindole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.