![(E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate structure](/static/products/848/848672-63-9.png)
(E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
TL;DR: (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate (CAS 848672-63-9) is a chemical compound with molecular formula C17H17N3O5S and molecular weight 375.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-[(2E)-2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, methyl 2-({[(2E)-2-(furan-2-ylmethylidene)hydrazinyl](oxo)acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, methyl 2-[[2-[(2E)-2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C17H17N3O5S |
|---|---|
| Molecular Weight | 375.09 g/mol |
| LogP | 2.0953 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.0889 |
| Heavy Atoms | 26 |
| Complexity | 854.13025 |
Chemical Identifiers
| CAS Number | 848672-63-9 |
|---|---|
| SMILES | COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C(=O)N/N=C/C3=CC=CO3 |
Product Overview
(E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate (CAS 848672-63-9), with molecular formula C17H17N3O5S and molecular weight 375.09 g/mol. IUPAC: methyl 2-[[2-[(2E)-2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
Property Insights of (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
The XLogP value of 2.0953 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate. Following Lipinski's Rule of Five, (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate?
The CAS number of (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate is 848672-63-9.
What is the molecular formula of (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate?
The molecular formula of (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate is C17H17N3O5S.
What is the molecular weight of (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate?
The molecular weight of (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate is 375.09 g/mol.
Where can I buy (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate?
You can request a quote for (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-methyl 2-(2-(2-(furan-2-ylmethylene)hydrazinyl)-2-oxoacetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.