![isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate structure](/static/products/5577/557776-68-8.webp)
isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate
TL;DR: isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate (CAS 557776-68-8) is a chemical compound with molecular formula C21H25NO4S and molecular weight 387.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-ethyl-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-5-methylthiophene-3-carboxylate
Also Known As: isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate, propan-2-yl 4-ethyl-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-5-methylthiophene-3-carboxylate, (E)-isopropyl 4-ethyl-2-(3-(4-methoxyphenyl)acrylamido)-5-methylthiophene-3-carboxylate, methylethyl 2-[(2E)-3-(4-methoxyphenyl)prop-2-enoylamino]-4-ethyl-5-methylthio phene-3-carboxylate, propan-2-yl 4-ethyl-2-{[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]amino}-5-methylthiophene-3-carboxylate
| Molecular Formula | C21H25NO4S |
|---|---|
| Molecular Weight | 387.15 g/mol |
| LogP | 4.84462 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 387.15042 |
| Heavy Atoms | 27 |
| Complexity | 834.61163 |
Chemical Identifiers
| CAS Number | 557776-68-8 |
|---|---|
| SMILES | CCC1=C(SC(=C1C(=O)OC(C)C)NC(=O)/C=C/C2=CC=C(C=C2)OC)C |
Product Overview
isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate (CAS 557776-68-8), with molecular formula C21H25NO4S and molecular weight 387.15 g/mol. IUPAC: propan-2-yl 4-ethyl-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-5-methylthiophene-3-carboxylate.
Chemical Property Profile of isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate
Property Insights of isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate
The XLogP value of 4.84462 indicates that isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate. Following Lipinski's Rule of Five, isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate has 1 hydrogen bond donor(s) and 5 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 isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate?
The CAS number of isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate is 557776-68-8.
What is the molecular formula of isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate?
The molecular formula of isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate is C21H25NO4S.
What is the molecular weight of isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate?
The molecular weight of isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate is 387.15 g/mol.
Where can I buy isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate?
You can request a quote for isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for isopropyl 4-ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.