Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate
TL;DR: Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate (CAS 462615-13-0) is a chemical compound with molecular formula C20H15ClN2O4S and molecular weight 414.0441 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 5-[[5-(3-chlorophenyl)furan-2-carbonyl]amino]-4-cyano-3-methylthiophene-2-carboxylate
Also Known As: Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate, ethyl 5-({[5-(3-chlorophenyl)furan-2-yl]carbonyl}amino)-4-cyano-3-methylthiophene-2-carboxylate, ethyl 5-[[5-(3-chlorophenyl)furan-2-carbonyl]amino]-4-cyano-3-methylthiophene-2-carboxylate, ethyl 5-{[5-(3-chlorophenyl)(2-furyl)]carbonylamino}-4-cyano-3-methylthiophene -2-carboxylate
Technical Specifications
| Molecular Formula | C20H15ClN2O4S |
| Molecular Weight | 414.0441 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.0441 Da |
| Heavy Atoms | 28 |
| Complexity | 639.0 |
| SMILES | CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC=C(O2)C3=CC(=CC=C3)Cl)C#N)C |
| InChIKey | JSZAGANPOXBDTG-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate
Property Insights of Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate
The XLogP value of 5.6 indicates that Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate?
The CAS number of Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate is 462615-13-0.
What is the molecular formula of Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate?
The molecular formula of Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate is C20H15ClN2O4S.
What is the molecular weight of Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate?
The molecular weight of Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate is 414.0441 g/mol.
Where can I buy Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate?
You can request a quote for Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 5-(5-(3-chlorophenyl)furan-2-carboxamido)-4-cyano-3-methylthiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.