![4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate structure](/static/products/844/844858-28-2.png)
4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate
TL;DR: 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate (CAS 844858-28-2) is a chemical compound with molecular formula C19H15Cl2NO5S2 and molecular weight 470.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-O-ethyl 2-O-methyl 5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate, 4-ethyl 2-methyl 5-{[(3,6-dichloro-1-benzothiophen-2-yl)carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate, 4-O-ethyl 2-O-methyl 5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate, Ethyl Methyl 5-[(3,6-dichlorobenzothiophene-2-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylate
| Molecular Formula | C19H15Cl2NO5S2 |
|---|---|
| Molecular Weight | 470.98 g/mol |
| LogP | 5.79362 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 470.97687 |
| Heavy Atoms | 29 |
| Complexity | 1135.515 |
Chemical Identifiers
| CAS Number | 844858-28-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl |
Product Overview
4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate (CAS 844858-28-2), with molecular formula C19H15Cl2NO5S2 and molecular weight 470.98 g/mol. IUPAC: 4-O-ethyl 2-O-methyl 5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate.
Chemical Property Profile of 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate
Property Insights of 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate
The XLogP value of 5.79362 indicates that 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-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 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate. Following Lipinski's Rule of Five, 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate?
The CAS number of 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate is 844858-28-2.
What is the molecular formula of 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate?
The molecular formula of 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate is C19H15Cl2NO5S2.
What is the molecular weight of 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate?
The molecular weight of 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate is 470.98 g/mol.
Where can I buy 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate?
You can request a quote for 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-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 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-ethyl 2-methyl 5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.