1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea
TL;DR: 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea (CAS 1164508-99-9) is a chemical compound with molecular formula C13H11N3O2S and molecular weight 273.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(furan-2-yl)-N-(pyridin-2-ylcarbamothioyl)prop-2-enamide
Also Known As: 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea, (E)-3-(furan-2-yl)-N-(pyridin-2-ylcarbamothioyl)acrylamide, (2E)-3-(2-furyl)-N-[(2-pyridylamino)thioxomethyl]prop-2-enamide, (2E)-3-(furan-2-yl)-N-(pyridin-2-ylcarbamothioyl)prop-2-enamide, (E)-3-(furan-2-yl)-N-(pyridin-2-ylcarbamothioyl)prop-2-enamide
| Molecular Formula | C13H11N3O2S |
|---|---|
| Molecular Weight | 273.06 g/mol |
| LogP | 2.201 |
| Topological Polar Surface Area | 67.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.0572 |
| Heavy Atoms | 19 |
| Complexity | 579.2005 |
Chemical Identifiers
| CAS Number | 1164508-99-9 |
|---|---|
| SMILES | C1=CC=NC(=C1)NC(=S)NC(=O)/C=C/C2=CC=CO2 |
Product Overview
1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea (CAS 1164508-99-9), with molecular formula C13H11N3O2S and molecular weight 273.06 g/mol. IUPAC: (E)-3-(furan-2-yl)-N-(pyridin-2-ylcarbamothioyl)prop-2-enamide.
Chemical Property Profile of 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea
Property Insights of 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea
The XLogP value of 2.201 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea. The TPSA of 67.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea. Following Lipinski's Rule of Five, 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea has 2 hydrogen bond donor(s) and 4 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 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea?
The CAS number of 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea is 1164508-99-9.
What is the molecular formula of 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea?
The molecular formula of 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea is C13H11N3O2S.
What is the molecular weight of 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea?
The molecular weight of 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea is 273.06 g/mol.
Where can I buy 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea?
You can request a quote for 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-((E)-3-Furan-2-yl-acryloyl)-3-pyridin-2-yl-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.