![1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea structure](/static/products/3554/355411-90-4.webp)
1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea
TL;DR: 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea (CAS 355411-90-4) is a chemical compound with molecular formula C13H9F3N2O2S and molecular weight 314.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide
Also Known As: BIM-0004379.P001, J1.703.457J, 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea, AB00102957-01, 1-[3-(Trifluoromethyl)phenyl]-3-(2-furoyl)thiourea
| Molecular Formula | C13H9F3N2O2S |
|---|---|
| Molecular Weight | 314.03 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 86.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.0337 |
| Heavy Atoms | 21 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 355411-90-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=CO2)C(F)(F)F |
| InChIKey | WAVCNPDOCRBSOO-UHFFFAOYSA-N |
Product Overview
1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea (CAS 355411-90-4), with molecular formula C13H9F3N2O2S and molecular weight 314.03 g/mol. IUPAC: N-[[3-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide.
Chemical Property Profile of 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea
Property Insights of 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea
The XLogP value of 3.8 indicates that 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea. Following Lipinski's Rule of Five, 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea 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 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea?
The CAS number of 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea is 355411-90-4.
What is the molecular formula of 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea?
The molecular formula of 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea is C13H9F3N2O2S.
What is the molecular weight of 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea?
The molecular weight of 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea is 314.03 g/mol.
Where can I buy 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea?
You can request a quote for 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Furoyl)-3-[3-(trifluoromethyl)phenyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.