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N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide
TL;DR: N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide (CAS 792946-84-0) is a chemical compound with molecular formula C16H9F7N2OS and molecular weight 410.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide
Also Known As: N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide, N-{[3,5-bis(trifluoromethyl)phenyl]carbamothioyl}-3-fluorobenzamide
| Molecular Formula | C16H9F7N2OS |
|---|---|
| Molecular Weight | 410.03 g/mol |
| LogP | 4.9901 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 410.03238 |
| Heavy Atoms | 27 |
| Complexity | 845.553 |
Chemical Identifiers
| CAS Number | 792946-84-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)C(=O)NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F |
Product Overview
N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide (CAS 792946-84-0), with molecular formula C16H9F7N2OS and molecular weight 410.03 g/mol. IUPAC: N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide.
Chemical Property Profile of N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide
Property Insights of N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide
The XLogP value of 4.9901 indicates that N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide has 2 hydrogen bond donor(s) and 2 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-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide?
The CAS number of N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide is 792946-84-0.
What is the molecular formula of N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide?
The molecular formula of N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide is C16H9F7N2OS.
What is the molecular weight of N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide?
The molecular weight of N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide is 410.03 g/mol.
Where can I buy N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide?
You can request a quote for N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-3-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.