![diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate structure](/static/products/2908/290835-18-6.webp)
diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate
TL;DR: diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate (CAS 290835-18-6) is a chemical compound with molecular formula C20H21NO5S and molecular weight 387.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 3-methyl-5-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-2,4-dicarboxylate
Also Known As: BAS 00568144, diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate, diethyl 5-cinnamamido-3-methylthiophene-2,4-dicarboxylate, 2,4-DIETHYL 3-METHYL-5-[(2E)-3-PHENYLPROP-2-ENAMIDO]THIOPHENE-2,4-DICARBOXYLATE, diethyl 3-methyl-5-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-2,4-dicarboxylate
| Molecular Formula | C20H21NO5S |
|---|---|
| Molecular Weight | 387.11 g/mol |
| LogP | 4.06182 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 387.11404 |
| Heavy Atoms | 27 |
| Complexity | 854.7571 |
Chemical Identifiers
| CAS Number | 290835-18-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)/C=C/C2=CC=CC=C2 |
Product Overview
diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate (CAS 290835-18-6), with molecular formula C20H21NO5S and molecular weight 387.11 g/mol. IUPAC: diethyl 3-methyl-5-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-2,4-dicarboxylate.
Chemical Property Profile of diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate
Property Insights of diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate
The XLogP value of 4.06182 indicates that diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate 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 diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate. Following Lipinski's Rule of Five, diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate 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 diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate?
The CAS number of diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate is 290835-18-6.
What is the molecular formula of diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate?
The molecular formula of diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate is C20H21NO5S.
What is the molecular weight of diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate?
The molecular weight of diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate is 387.11 g/mol.
Where can I buy diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate?
You can request a quote for diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for diethyl 3-methyl-5-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-2,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.