ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate
TL;DR: ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate (CAS 713112-72-2) is a chemical compound with molecular formula C21H28N2O5S and molecular weight 420.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(diethylamino)acetyl]amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate
Also Known As: ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate, Ethyl 2-[(2-diethylaminoacetyl)amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate, ethyl 2-[(N,N-diethylglycyl)amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate, ethyl 2-[[2-(diethylamino)acetyl]amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate
| Molecular Formula | C21H28N2O5S |
|---|---|
| Molecular Weight | 420.17 g/mol |
| LogP | 3.8893 |
| Topological Polar Surface Area | 77.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 420.1719 |
| Heavy Atoms | 29 |
| Complexity | 845.59216 |
Chemical Identifiers
| CAS Number | 713112-72-2 |
|---|---|
| SMILES | CCN(CC)CC(=O)NC1=C(C(=CS1)C2=CC(=C(C=C2)OC)OC)C(=O)OCC |
Product Overview
ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate (CAS 713112-72-2), with molecular formula C21H28N2O5S and molecular weight 420.17 g/mol. IUPAC: ethyl 2-[[2-(diethylamino)acetyl]amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate.
Chemical Property Profile of ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate
Property Insights of ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate
The XLogP value of 3.8893 indicates that ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.1 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate. Following Lipinski's Rule of Five, ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate has 1 hydrogen bond donor(s) and 7 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 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate?
The CAS number of ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate is 713112-72-2.
What is the molecular formula of ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate?
The molecular formula of ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate is C21H28N2O5S.
What is the molecular weight of ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate?
The molecular weight of ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate is 420.17 g/mol.
Where can I buy ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate?
You can request a quote for ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)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 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-(2-(diethylamino)acetamido)-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.