Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate
TL;DR: Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate (CAS 1024742-76-4) is a chemical compound with molecular formula C20H23NO5S and molecular weight 389.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(4-ethoxyanilino)-2-(4-methylphenyl)sulfonylprop-2-enoate
Also Known As: ETHYL 3-((4-ETHOXYPHENYL)AMINO)-2-((4-METHYLPHENYL)SULFONYL)PROP-2-ENOATE, ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate, ethyl 3-(4-ethoxyanilino)-2-(4-methylphenyl)sulfonylprop-2-enoate, Ethyl 3-[(4-ethoxyphenyl)amino]-2-(4-methylphenyl)sulfonyl-prop-2-enoate
| Molecular Formula | C20H23NO5S |
|---|---|
| Molecular Weight | 389.13 g/mol |
| LogP | 3.68402 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 389.1297 |
| Heavy Atoms | 27 |
| Complexity | 900.3932 |
Chemical Identifiers
| CAS Number | 1024742-76-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC=C(C(=O)OCC)S(=O)(=O)C2=CC=C(C=C2)C |
Product Overview
Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate (CAS 1024742-76-4), with molecular formula C20H23NO5S and molecular weight 389.13 g/mol. IUPAC: ethyl 3-(4-ethoxyanilino)-2-(4-methylphenyl)sulfonylprop-2-enoate.
Chemical Property Profile of Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate
Property Insights of Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate
The XLogP value of 3.68402 indicates that Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate. Following Lipinski's Rule of Five, Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate 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
Frequently Asked Questions
What is the CAS number of Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate?
The CAS number of Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate is 1024742-76-4.
What is the molecular formula of Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate?
The molecular formula of Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate is C20H23NO5S.
What is the molecular weight of Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate?
The molecular weight of Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate is 389.13 g/mol.
Where can I buy Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate?
You can request a quote for Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)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 Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(4-ethoxyanilino)-2-(p-tolylsulfonyl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.