ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate
TL;DR: ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate (CAS 495386-01-1) is a chemical compound with molecular formula C23H22ClNO5S and molecular weight 459.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate
Also Known As: ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate, ethyl 4-(2-chlorophenyl)-2-{[(3,4-dimethoxyphenyl)acetyl]amino}-3-thiophenecarboxylate, ethyl 2-[2-(3,4-dimethoxyphenyl)acetylamino]-4-(2-chlorophenyl)thiophene-3-car boxylate, ethyl 4-(2-chlorophenyl)-2-{[(3,4-dimethoxyphenyl)acetyl]amino}thiophene-3-carboxylate
| Molecular Formula | C23H22ClNO5S |
|---|---|
| Molecular Weight | 459.09 g/mol |
| LogP | 5.4436 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 459.09073 |
| Heavy Atoms | 31 |
| Complexity | 1095.3209 |
Chemical Identifiers
| CAS Number | 495386-01-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)CC3=CC(=C(C=C3)OC)OC |
Product Overview
ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate (CAS 495386-01-1), with molecular formula C23H22ClNO5S and molecular weight 459.09 g/mol. IUPAC: ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate
Property Insights of ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate
The XLogP value of 5.4436 indicates that ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate. Following Lipinski's Rule of Five, ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate?
The CAS number of ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate is 495386-01-1.
What is the molecular formula of ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate?
The molecular formula of ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate is C23H22ClNO5S.
What is the molecular weight of ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate?
The molecular weight of ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate is 459.09 g/mol.
Where can I buy ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate?
You can request a quote for ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]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 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(2-chlorophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.