N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide
TL;DR: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide (CAS 6311-09-7) is a chemical compound with molecular formula C19H18Cl2N2O2S and molecular weight 408.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2,5-dichlorophenoxy)acetamide
Also Known As: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide, N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2,5-dichlorophenoxy)acetamide
| Molecular Formula | C19H18Cl2N2O2S |
|---|---|
| Molecular Weight | 408.05 g/mol |
| LogP | 5.45898 |
| Topological Polar Surface Area | 62.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 408.0466 |
| Heavy Atoms | 26 |
| Complexity | 873.15454 |
Chemical Identifiers
| CAS Number | 6311-09-7 |
|---|---|
| SMILES | CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)COC3=C(C=CC(=C3)Cl)Cl |
Product Overview
N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide (CAS 6311-09-7), with molecular formula C19H18Cl2N2O2S and molecular weight 408.05 g/mol. IUPAC: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2,5-dichlorophenoxy)acetamide.
Chemical Property Profile of N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide
Property Insights of N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide
The XLogP value of 5.45898 indicates that N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.12 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide. Following Lipinski's Rule of Five, N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide has 1 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-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide?
The CAS number of N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide is 6311-09-7.
What is the molecular formula of N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide?
The molecular formula of N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide is C19H18Cl2N2O2S.
What is the molecular weight of N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide?
The molecular weight of N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide is 408.05 g/mol.
Where can I buy N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide?
You can request a quote for N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide 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-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,5-dichlorophenoxy)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.