[4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate
TL;DR: [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate (CAS 378209-19-9) is a chemical compound with molecular formula C23H15ClO5S and molecular weight 438.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate
Also Known As: [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate|(E)-4-(4-methoxyphenyl)-2-oxobenzo[d][1,3]oxathiol-5-yl 3-(4-chlorophenyl)acrylate|4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl (2E)-3-(4-chlorophenyl)prop-2-enoate
| Molecular Formula | C23H15ClO5S |
|---|---|
| Molecular Weight | 438.03 g/mol |
| LogP | 5.8023 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.03287 |
| Heavy Atoms | 30 |
| Complexity | 1284.1753 |
Chemical Identifiers
| CAS Number | 378209-19-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C(C=CC3=C2SC(=O)O3)OC(=O)/C=C/C4=CC=C(C=C4)Cl |
Product Overview
[4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate (CAS 378209-19-9), with molecular formula C23H15ClO5S and molecular weight 438.03 g/mol. IUPAC: [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate.
Chemical Property Profile of [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate
Property Insights of [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate
The XLogP value of 5.8023 indicates that [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate. Following Lipinski's Rule of Five, [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate?
The CAS number of [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate is 378209-19-9.
What is the molecular formula of [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate?
The molecular formula of [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate is C23H15ClO5S.
What is the molecular weight of [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate?
The molecular weight of [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate is 438.03 g/mol.
Where can I buy [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate?
You can request a quote for [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for [4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (E)-3-(4-chlorophenyl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.