N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide
TL;DR: N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide (CAS 752230-38-9) is a chemical compound with molecular formula C15H11F3N2OS and molecular weight 324.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide
Also Known As: N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide, F2590-0034, N-(3-CYANO-4,5-DIMETHYL-2-THIENYL)-3-(TRIFLUOROMETHYL)BENZAMIDE
| Molecular Formula | C15H11F3N2OS |
|---|---|
| Molecular Weight | 324.05 g/mol |
| LogP | 4.50772 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 324.0544 |
| Heavy Atoms | 22 |
| Complexity | 772.0704 |
Chemical Identifiers
| CAS Number | 752230-38-9 |
|---|---|
| SMILES | CC1=C(SC(=C1C#N)NC(=O)C2=CC(=CC=C2)C(F)(F)F)C |
Product Overview
N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide (CAS 752230-38-9), with molecular formula C15H11F3N2OS and molecular weight 324.05 g/mol. IUPAC: N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide.
Chemical Property Profile of N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide
Property Insights of N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide
The XLogP value of 4.50772 indicates that N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide has 1 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-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide?
The CAS number of N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide is 752230-38-9.
What is the molecular formula of N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide?
The molecular formula of N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide is C15H11F3N2OS.
What is the molecular weight of N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide?
The molecular weight of N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide is 324.05 g/mol.
Where can I buy N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide?
You can request a quote for N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-(trifluoromethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.