![2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide structure](/static/products/4381/438195-92-7.webp)
2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
TL;DR: 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide (CAS 438195-92-7) is a chemical compound with molecular formula C26H36N2O3S and molecular weight 456.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 2-{[2-(3,4-dimethylphenoxy)butanoyl]amino}-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 2-{[2-(3,4-dimethylphenoxy)butanoyl]amino}-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(1,1-dimethylpropyl)-4,5,6,7-tetrah ydrobenzo[b]thiophene-3-carboxamide
| Molecular Formula | C26H36N2O3S |
|---|---|
| Molecular Weight | 456.24 g/mol |
| LogP | 5.80104 |
| Topological Polar Surface Area | 81.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 456.24466 |
| Heavy Atoms | 32 |
| Complexity | 1008.7412 |
Chemical Identifiers
| CAS Number | 438195-92-7 |
|---|---|
| SMILES | CCC(C(=O)NC1=C(C2=C(S1)CC(CC2)C(C)(C)CC)C(=O)N)OC3=CC(=C(C=C3)C)C |
Product Overview
2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide (CAS 438195-92-7), with molecular formula C26H36N2O3S and molecular weight 456.24 g/mol. IUPAC: 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Property Insights of 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
The XLogP value of 5.80104 indicates that 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide. Following Lipinski's Rule of Five, 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide 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 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
The CAS number of 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is 438195-92-7.
What is the molecular formula of 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
The molecular formula of 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is C26H36N2O3S.
What is the molecular weight of 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
The molecular weight of 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is 456.24 g/mol.
Where can I buy 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
You can request a quote for 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(3,4-dimethylphenoxy)butanoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.