![ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate structure](/static/products/3545/354545-53-2.webp)
ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate
TL;DR: ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate (CAS 354545-53-2) is a chemical compound with molecular formula C23H27NO4S and molecular weight 413.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate
Also Known As: ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate, ethyl 5-acetyl-2-{[3-(4-tert-butylphenyl)acryloyl]amino}-4-methyl-3-thiophenecarboxylate, ethyl 5-acetyl-2-{[(2E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino}-4-methylthiophene-3-carboxylate
| Molecular Formula | C23H27NO4S |
|---|---|
| Molecular Weight | 413.17 g/mol |
| LogP | 5.38522 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.16608 |
| Heavy Atoms | 29 |
| Complexity | 946.49286 |
Chemical Identifiers
| CAS Number | 354545-53-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)/C=C/C2=CC=C(C=C2)C(C)(C)C |
Product Overview
ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate (CAS 354545-53-2), with molecular formula C23H27NO4S and molecular weight 413.17 g/mol. IUPAC: ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate
Property Insights of ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate
The XLogP value of 5.38522 indicates that ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate. Following Lipinski's Rule of Five, ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate has 1 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 ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate?
The CAS number of ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate is 354545-53-2.
What is the molecular formula of ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate?
The molecular formula of ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate is C23H27NO4S.
What is the molecular weight of ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate?
The molecular weight of ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate is 413.17 g/mol.
Where can I buy ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate?
You can request a quote for ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-acetyl-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.