![[3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate structure](/static/products/1061/106128-43-2.webp)
[3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate
TL;DR: [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate (CAS 106128-43-2) is a chemical compound with molecular formula C18H19NO2S2 and molecular weight 345.08572 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate
Also Known As: 3-(2-Furanyl)-3-oxo-1-phenyl-1-propenyl diethylcarbamodithioate, Carbamodithioic acid,diethyl-, 3-(2-furanyl)-3-oxo-1-phenyl-1-propenyl ester (9CI), Diethylcarbamodithioic acid 3-(2-furanyl)-3-oxo-1-phenyl-1-propenyl ester, CARBAMODITHIOIC ACID, DIETHYL-, 3-(2-FURANYL)-3-OXO-1-PHENYL-1-PROPENYL ESTER
Technical Specifications
| Molecular Formula | C18H19NO2S2 |
| Molecular Weight | 345.08572 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 90.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 345.08572 Da |
| Heavy Atoms | 23 |
| Complexity | 440.0 |
| SMILES | CCN(CC)C(=S)SC(=CC(=O)C1=CC=CO1)C2=CC=CC=C2 |
| InChIKey | KJEALDFPZYBTQY-UHFFFAOYSA-N |
Chemical Property Profile of [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate
Property Insights of [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate
The XLogP value of 4.5 indicates that [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.8 Ų falls within the moderate polarity range, balancing permeability and solubility for [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate. Following Lipinski's Rule of Five, [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate?
The CAS number of [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate is 106128-43-2.
What is the molecular formula of [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate?
The molecular formula of [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate is C18H19NO2S2.
What is the molecular weight of [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate?
The molecular weight of [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate is 345.08572 g/mol.
Where can I buy [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate?
You can request a quote for [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate?
Yes, CoreyChem provides custom synthesis services for [3-(furan-2-yl)-3-oxo-1-phenylprop-1-enyl] N,N-diethylcarbamodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.