![N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide structure](/static/products/488/488095-92-7.png)
N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide
TL;DR: N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide (CAS 488095-92-7) is a chemical compound with molecular formula C20H17F6N3O2S and molecular weight 477.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-methoxybenzamide
Also Known As: N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide, N-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-methoxybenzamide, N-{2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}-2-methoxybenzamide
| Molecular Formula | C20H17F6N3O2S |
|---|---|
| Molecular Weight | 477.09 g/mol |
| LogP | 5.16998 |
| Topological Polar Surface Area | 74.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 477.09457 |
| Heavy Atoms | 32 |
| Complexity | 1041.0703 |
Chemical Identifiers
| CAS Number | 488095-92-7 |
|---|---|
| SMILES | COC1=CC=CC=C1C(=O)NC(C(F)(F)F)(C(F)(F)F)NC2=C(C3=C(S2)CCCC3)C#N |
Product Overview
N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide (CAS 488095-92-7), with molecular formula C20H17F6N3O2S and molecular weight 477.09 g/mol. IUPAC: N-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-methoxybenzamide.
Chemical Property Profile of N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide
Property Insights of N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide
The XLogP value of 5.16998 indicates that N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.15 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide. Following Lipinski's Rule of Five, N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide has 2 hydrogen bond donor(s) and 5 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-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide?
The CAS number of N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide is 488095-92-7.
What is the molecular formula of N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide?
The molecular formula of N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide is C20H17F6N3O2S.
What is the molecular weight of N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide?
The molecular weight of N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide is 477.09 g/mol.
Where can I buy N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide?
You can request a quote for N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide 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-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.