N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide
TL;DR: N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide (CAS 543717-70-0) is a chemical compound with molecular formula C14H11FN2OS and molecular weight 274.06 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)-2-fluorobenzamide
Also Known As: BAS 11134082, N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide, AH-034/10836058, N-(3-cyano-4,5-dimethyl-2-thienyl)-2-fluorobenzamide, N-(3-Cyano-4,5-dimethyl-thiophen-2-yl)-2-fluoro-benzamide
| Molecular Formula | C14H11FN2OS |
|---|---|
| Molecular Weight | 274.06 g/mol |
| LogP | 3.62802 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.05762 |
| Heavy Atoms | 19 |
| Complexity | 685.2398 |
Chemical Identifiers
| CAS Number | 543717-70-0 |
|---|---|
| SMILES | CC1=C(SC(=C1C#N)NC(=O)C2=CC=CC=C2F)C |
Product Overview
N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide (CAS 543717-70-0), with molecular formula C14H11FN2OS and molecular weight 274.06 g/mol. IUPAC: N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide.
Chemical Property Profile of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide
Property Insights of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide
The XLogP value of 3.62802 indicates that N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide 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)-2-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide 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)-2-fluorobenzamide?
The CAS number of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide is 543717-70-0.
What is the molecular formula of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide?
The molecular formula of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide is C14H11FN2OS.
What is the molecular weight of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide?
The molecular weight of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide is 274.06 g/mol.
Where can I buy N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide?
You can request a quote for N-(3-cyano-4,5-dimethylthiophen-2-yl)-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-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.