5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide
TL;DR: 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide (CAS 536722-74-4) is a chemical compound with molecular formula C13H8BrF3N2O2S and molecular weight 391.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide
Also Known As: UPCMLD0ENAT5874167:001, F1201-0168, 3-(5-bromofuran-2-carbonyl)-1-[3-(trifluoromethyl)phenyl]thiourea, 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide, 5-bromo-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide
| Molecular Formula | C13H8BrF3N2O2S |
|---|---|
| Molecular Weight | 391.94 g/mol |
| LogP | 4.1877 |
| Topological Polar Surface Area | 54.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 391.9442 |
| Heavy Atoms | 22 |
| Complexity | 715.3059 |
Chemical Identifiers
| CAS Number | 536722-74-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=C(O2)Br)C(F)(F)F |
Product Overview
5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide (CAS 536722-74-4), with molecular formula C13H8BrF3N2O2S and molecular weight 391.94 g/mol. IUPAC: 5-bromo-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide.
Chemical Property Profile of 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide
Property Insights of 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide
The XLogP value of 4.1877 indicates that 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.27 Ų, 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide has 2 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 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide?
The CAS number of 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide is 536722-74-4.
What is the molecular formula of 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide?
The molecular formula of 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide is C13H8BrF3N2O2S.
What is the molecular weight of 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide?
The molecular weight of 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide is 391.94 g/mol.
Where can I buy 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide?
You can request a quote for 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-N-((3-(trifluoromethyl)phenyl)carbamothioyl)furan-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.