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Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate
TL;DR: Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate (CAS 442658-73-3) is a chemical compound with molecular formula C20H25NO5S and molecular weight 391.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(4-ethoxyphenyl)sulfonylamino]-3-(4-methylphenyl)propanoate
Also Known As: ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate, A2793/0118029, ethyl 3-(4-ethoxybenzenesulfonamido)-3-(4-methylphenyl)propanoate, 3-(4-Ethoxy-benzenesulfonylamino)-3-p-tolyl-propionic acid ethyl ester, Ethyl 3-([(4-ethoxyphenyl)sulfonyl]amino)-3-(4-methylphenyl)propanoate #
| Molecular Formula | C20H25NO5S |
|---|---|
| Molecular Weight | 391.15 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 90.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 391.14536 |
| Heavy Atoms | 27 |
| Complexity | 543.0 |
Chemical Identifiers
| CAS Number | 442658-73-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)OCC)C2=CC=C(C=C2)C |
| InChIKey | KOFCVSVPQWCFGA-UHFFFAOYSA-N |
Product Overview
Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate (CAS 442658-73-3), with molecular formula C20H25NO5S and molecular weight 391.15 g/mol. IUPAC: ethyl 3-[(4-ethoxyphenyl)sulfonylamino]-3-(4-methylphenyl)propanoate.
Chemical Property Profile of Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate
Property Insights of Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate
The XLogP value of 3.3 indicates that Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate. Following Lipinski's Rule of Five, Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate 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-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate?
The CAS number of Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate is 442658-73-3.
What is the molecular formula of Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate?
The molecular formula of Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate is C20H25NO5S.
What is the molecular weight of Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate?
The molecular weight of Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate is 391.15 g/mol.
Where can I buy Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate?
You can request a quote for Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate 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-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-{[(4-ethoxyphenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.