N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide
TL;DR: N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide (CAS 673454-64-3) is a chemical compound with molecular formula C15H11F3N2O2S and molecular weight 340.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[2-(difluoromethoxy)phenyl]carbamothioyl]-2-fluorobenzamide
Also Known As: N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide, N-[[2-(difluoromethoxy)phenyl]carbamothioyl]-2-fluorobenzamide, N-{[2-(difluoromethoxy)phenyl]carbamothioyl}-2-fluorobenzamide
| Molecular Formula | C15H11F3N2O2S |
|---|---|
| Molecular Weight | 340.05 g/mol |
| LogP | 3.5539 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 340.04935 |
| Heavy Atoms | 23 |
| Complexity | 725.3731 |
Chemical Identifiers
| CAS Number | 673454-64-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=CC=C2OC(F)F)F |
Product Overview
N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide (CAS 673454-64-3), with molecular formula C15H11F3N2O2S and molecular weight 340.05 g/mol. IUPAC: N-[[2-(difluoromethoxy)phenyl]carbamothioyl]-2-fluorobenzamide.
Chemical Property Profile of N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide
Property Insights of N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide
The XLogP value of 3.5539 indicates that N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide 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 N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide?
The CAS number of N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide is 673454-64-3.
What is the molecular formula of N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide?
The molecular formula of N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide is C15H11F3N2O2S.
What is the molecular weight of N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide?
The molecular weight of N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide is 340.05 g/mol.
Where can I buy N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide?
You can request a quote for N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-((2-(difluoromethoxy)phenyl)carbamothioyl)-2-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.