N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide
TL;DR: N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide (CAS 497865-93-7) is a chemical compound with molecular formula C20H19F6N3OS and molecular weight 463.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-3-phenylpropanamide
Also Known As: N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide, N-[2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-3-phenylpropanamide, N-{2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}-3-phenylpropanamide
| Molecular Formula | C20H19F6N3OS |
|---|---|
| Molecular Weight | 463.12 g/mol |
| LogP | 5.4724 |
| Topological Polar Surface Area | 64.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 463.1153 |
| Heavy Atoms | 31 |
| Complexity | 946.2655 |
Chemical Identifiers
| CAS Number | 497865-93-7 |
|---|---|
| SMILES | CCC1=C(SC(=C1C#N)NC(C(F)(F)F)(C(F)(F)F)NC(=O)CCC2=CC=CC=C2)C |
Product Overview
N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide (CAS 497865-93-7), with molecular formula C20H19F6N3OS and molecular weight 463.12 g/mol. IUPAC: N-[2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-3-phenylpropanamide.
Chemical Property Profile of N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide
Property Insights of N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide
The XLogP value of 5.4724 indicates that N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.92 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide. Following Lipinski's Rule of Five, N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide?
The CAS number of N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide is 497865-93-7.
What is the molecular formula of N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide?
The molecular formula of N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide is C20H19F6N3OS.
What is the molecular weight of N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide?
The molecular weight of N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide is 463.12 g/mol.
Where can I buy N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide?
You can request a quote for N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.