N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide
TL;DR: N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide (CAS 351-29-1) is a chemical compound with molecular formula C9H8F3NOS and molecular weight 235.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(trifluoromethylsulfanyl)phenyl]acetamide
Also Known As: N-(3-((trifluoromethyl)thio)phenyl)acetamide, N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide, UPCMLD0ENAT0519-0863:001, N-{3-[(trifluoromethyl)thio]phenyl}acetamide, acetic acid-(3-trifluoromethylsulfanyl-anilide)
| Molecular Formula | C9H8F3NOS |
|---|---|
| Molecular Weight | 235.03 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.02786 |
| Heavy Atoms | 15 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 351-29-1 |
|---|---|
| SMILES | CC(=O)NC1=CC(=CC=C1)SC(F)(F)F |
| InChIKey | TVXYDNRPCYCOAP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide (CAS 351-29-1), with molecular formula C9H8F3NOS and molecular weight 235.03 g/mol. IUPAC: N-[3-(trifluoromethylsulfanyl)phenyl]acetamide.
Chemical Property Profile of N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide
Property Insights of N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide
The XLogP value of 3.3 indicates that N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide has 1 hydrogen bond donor(s) and 5 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-Trifluoromethylsulfanyl-phenyl)-acetamide?
The CAS number of N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide is 351-29-1.
What is the molecular formula of N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide?
The molecular formula of N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide is C9H8F3NOS.
What is the molecular weight of N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide?
The molecular weight of N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide is 235.03 g/mol.
Where can I buy N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide?
You can request a quote for N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-Trifluoromethylsulfanyl-phenyl)-acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.