![N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide structure](/static/products/5158/515872-37-4.webp)
N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide
TL;DR: N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide (CAS 515872-37-4) is a chemical compound with molecular formula C13H5Cl2F3N2OS and molecular weight 363.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-cyano-4-(2,4-dichlorophenyl)thiophen-2-yl]-2,2,2-trifluoroacetamide
Also Known As: N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide, N-[3-cyano-4-(2,4-dichlorophenyl)thiophen-2-yl]-2,2,2-trifluoroacetamide
| Molecular Formula | C13H5Cl2F3N2OS |
|---|---|
| Molecular Weight | 363.95 g/mol |
| LogP | 5.09438 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 363.94516 |
| Heavy Atoms | 22 |
| Complexity | 780.568 |
Chemical Identifiers
| CAS Number | 515872-37-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)C2=CSC(=C2C#N)NC(=O)C(F)(F)F |
Product Overview
N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide (CAS 515872-37-4), with molecular formula C13H5Cl2F3N2OS and molecular weight 363.95 g/mol. IUPAC: N-[3-cyano-4-(2,4-dichlorophenyl)thiophen-2-yl]-2,2,2-trifluoroacetamide.
Chemical Property Profile of N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide
Property Insights of N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide
The XLogP value of 5.09438 indicates that N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide 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-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide?
The CAS number of N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide is 515872-37-4.
What is the molecular formula of N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide?
The molecular formula of N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide is C13H5Cl2F3N2OS.
What is the molecular weight of N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide?
The molecular weight of N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide is 363.95 g/mol.
Where can I buy N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide?
You can request a quote for N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide 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-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-cyano-4-(2,4-dichlorophenyl)-2-thienyl]-2,2,2-trifluoroacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.