4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate
TL;DR: 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate (CAS 5343-78-2) is a chemical compound with molecular formula C24H20Cl2N2O6S2 and molecular weight 566.01 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-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate
| Molecular Formula | C24H20Cl2N2O6S2 |
|---|---|
| Molecular Weight | 566.01 g/mol |
| LogP | 6.11302 |
| Topological Polar Surface Area | 106.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 566.014 |
| Heavy Atoms | 36 |
| Complexity | 1362.5665 |
Chemical Identifiers
| CAS Number | 5343-78-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=S)NC(=O)C=CC2=CC=C(O2)C3=C(C(=CC=C3)Cl)Cl |
Product Overview
4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate (CAS 5343-78-2), with molecular formula C24H20Cl2N2O6S2 and molecular weight 566.01 g/mol. IUPAC: 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate.
Chemical Property Profile of 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate
Property Insights of 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate
The XLogP value of 6.11302 indicates that 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate. Following Lipinski's Rule of Five, 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate?
The CAS number of 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate is 5343-78-2.
What is the molecular formula of 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate?
The molecular formula of 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate is C24H20Cl2N2O6S2.
What is the molecular weight of 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate?
The molecular weight of 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate is 566.01 g/mol.
Where can I buy 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate?
You can request a quote for 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-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-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-O-ethyl 2-O-methyl 5-[3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.