![(E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate structure](/static/products/325/325765-92-2.png)
(E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate
TL;DR: (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate (CAS 325765-92-2) is a chemical compound with molecular formula C23H12ClF3O4S and molecular weight 476.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-7-[3-(trifluoromethyl)phenyl]-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate
Also Known As: (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate, [2-oxo-7-[3-(trifluoromethyl)phenyl]-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate, 2-oxo-7-[3-(trifluoromethyl)phenyl]-1,3-benzoxathiol-5-yl (2E)-3-(4-chlorophenyl)prop-2-enoate, 2-oxo-7-[3-(trifluoromethyl)phenyl]benzo[3,4-d]1,3-oxathiolan-5-yl (2E)-3-(4-c hlorophenyl)prop-2-enoate
| Molecular Formula | C23H12ClF3O4S |
|---|---|
| Molecular Weight | 476.01 g/mol |
| LogP | 6.8125 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 476.0097 |
| Heavy Atoms | 32 |
| Complexity | 1385.1316 |
Chemical Identifiers
| CAS Number | 325765-92-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C2=C3C(=CC(=C2)OC(=O)/C=C/C4=CC=C(C=C4)Cl)SC(=O)O3 |
Product Overview
(E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate (CAS 325765-92-2), with molecular formula C23H12ClF3O4S and molecular weight 476.01 g/mol. IUPAC: [2-oxo-7-[3-(trifluoromethyl)phenyl]-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate.
Chemical Property Profile of (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate
Property Insights of (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate
The XLogP value of 6.8125 indicates that (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.51 Ų, (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate?
The CAS number of (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate is 325765-92-2.
What is the molecular formula of (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate?
The molecular formula of (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate is C23H12ClF3O4S.
What is the molecular weight of (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate?
The molecular weight of (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate is 476.01 g/mol.
Where can I buy (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate?
You can request a quote for (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-oxo-7-(3-(trifluoromethyl)phenyl)benzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.