![Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate structure](/static/products/6860/6860-65-7.webp)
Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
TL;DR: Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate (CAS 6860-65-7) is a chemical compound with molecular formula C28H30N2O5S and molecular weight 506.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[4-(benzylcarbamoyl)phenoxy]acetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-[[2-[4-(benzylcarbamoyl)phenoxy]acetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C28H30N2O5S |
|---|---|
| Molecular Weight | 506.19 g/mol |
| LogP | 4.9971 |
| Topological Polar Surface Area | 93.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 506.18753 |
| Heavy Atoms | 36 |
| Complexity | 1220.742 |
Chemical Identifiers
| CAS Number | 6860-65-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)COC3=CC=C(C=C3)C(=O)NCC4=CC=CC=C4 |
Product Overview
Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate (CAS 6860-65-7), with molecular formula C28H30N2O5S and molecular weight 506.19 g/mol. IUPAC: ethyl 2-[[2-[4-(benzylcarbamoyl)phenoxy]acetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Property Insights of Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
The XLogP value of 4.9971 indicates that Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.73 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate?
The CAS number of Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate is 6860-65-7.
What is the molecular formula of Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate?
The molecular formula of Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate is C28H30N2O5S.
What is the molecular weight of Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate?
The molecular weight of Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate is 506.19 g/mol.
Where can I buy Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate?
You can request a quote for Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-{2-[4-(benzylcarbamoyl)phenoxy]acetamido}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.