(E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide
TL;DR: (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide (CAS 78374-79-5) is a chemical compound with molecular formula C13H16N2O2S and molecular weight 264.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide
Also Known As: BAS 00227206, 3-Furan-2-yl-N-(piperidine-1-carbothioyl)-acrylamide, (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide, (2E)-3-(2-furyl)-N-(piperidylthioxomethyl)prop-2-enamide, (E)-3-(furan-2-yl)-N-(piperidine-1-carbonothioyl)acrylamide
| Molecular Formula | C13H16N2O2S |
|---|---|
| Molecular Weight | 264.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 77.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.09326 |
| Heavy Atoms | 18 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 78374-79-5 |
|---|---|
| SMILES | C1CCN(CC1)C(=S)NC(=O)/C=C/C2=CC=CO2 |
| InChIKey | HRRREESSBPWQTF-VOTSOKGWSA-N |
Product Overview
(E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide (CAS 78374-79-5), with molecular formula C13H16N2O2S and molecular weight 264.09 g/mol. IUPAC: (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide.
Chemical Property Profile of (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide
Property Insights of (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide. The TPSA of 77.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide. Following Lipinski's Rule of Five, (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide has 1 hydrogen bond donor(s) and 3 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 (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide?
The CAS number of (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide is 78374-79-5.
What is the molecular formula of (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide?
The molecular formula of (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide is C13H16N2O2S.
What is the molecular weight of (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide?
The molecular weight of (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide is 264.09 g/mol.
Where can I buy (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide?
You can request a quote for (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(furan-2-yl)-N-(piperidine-1-carbothioyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.