![ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate structure](/static/products/4729/472996-76-2.webp)
ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate
TL;DR: ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate (CAS 472996-76-2) is a chemical compound with molecular formula C17H17NO3S and molecular weight 315.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate
Also Known As: ethyl 2-cinnamamido-5-methylthiophene-3-carboxylate, ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate, ethyl 5-methyl-2-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-3-carboxylate
| Molecular Formula | C17H17NO3S |
|---|---|
| Molecular Weight | 315.09 g/mol |
| LogP | 3.88512 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.09293 |
| Heavy Atoms | 22 |
| Complexity | 689.1846 |
Chemical Identifiers
| CAS Number | 472996-76-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1)C)NC(=O)/C=C/C2=CC=CC=C2 |
Product Overview
ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate (CAS 472996-76-2), with molecular formula C17H17NO3S and molecular weight 315.09 g/mol. IUPAC: ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate
Property Insights of ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate
The XLogP value of 3.88512 indicates that ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate has 1 hydrogen bond donor(s) and 4 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 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate?
The CAS number of ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate is 472996-76-2.
What is the molecular formula of ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate?
The molecular formula of ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate is C17H17NO3S.
What is the molecular weight of ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate?
The molecular weight of ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate is 315.09 g/mol.
Where can I buy ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate?
You can request a quote for ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-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-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.