Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate
TL;DR: Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate (CAS 312946-29-5) is a chemical compound with molecular formula C15H16N2O4S2 and molecular weight 352.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(furan-2-carbonylcarbamothioylamino)-4,5-dimethylthiophene-3-carboxylate
Also Known As: ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate, ethyl 2-(furan-2-carbonylcarbamothioylamino)-4,5-dimethylthiophene-3-carboxylate, ethyl 2-{[(furan-2-ylcarbonyl)carbamothioyl]amino}-4,5-dimethylthiophene-3-carboxylate, ETHYL 2-({[(2-FURYLCARBONYL)AMINO]CARBOTHIOYL}AMINO)-4,5-DIMETHYL-3-THIOPHENECARBOXYLATE
| Molecular Formula | C15H16N2O4S2 |
|---|---|
| Molecular Weight | 352.06 g/mol |
| LogP | 3.26144 |
| Topological Polar Surface Area | 80.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 352.05515 |
| Heavy Atoms | 23 |
| Complexity | 734.9959 |
Chemical Identifiers
| CAS Number | 312946-29-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C)NC(=S)NC(=O)C2=CC=CO2 |
Product Overview
Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate (CAS 312946-29-5), with molecular formula C15H16N2O4S2 and molecular weight 352.06 g/mol. IUPAC: ethyl 2-(furan-2-carbonylcarbamothioylamino)-4,5-dimethylthiophene-3-carboxylate.
Chemical Property Profile of Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate
Property Insights of Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate
The XLogP value of 3.26144 indicates that Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.57 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate has 2 hydrogen bond donor(s) and 6 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-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate?
The CAS number of Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate is 312946-29-5.
What is the molecular formula of Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate?
The molecular formula of Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate is C15H16N2O4S2.
What is the molecular weight of Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate?
The molecular weight of Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate is 352.06 g/mol.
Where can I buy Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate?
You can request a quote for Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-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-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(3-(furan-2-carbonyl)thioureido)-4,5-dimethylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.