![2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid structure](/static/products/905/905015-22-7.png)
2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid
TL;DR: 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid (CAS 905015-22-7) is a chemical compound with molecular formula C15H18N2O4S and molecular weight 322.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
Also Known As: 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid, 2-[(2-oxo-2-pyrrolidin-1-yl-acetyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid, 2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid, 2-{[oxo(pyrrolidin-1-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
| Molecular Formula | C15H18N2O4S |
|---|---|
| Molecular Weight | 322.10 g/mol |
| LogP | 1.886 |
| Topological Polar Surface Area | 86.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 322.09872 |
| Heavy Atoms | 22 |
| Complexity | 631.7321 |
Chemical Identifiers
| CAS Number | 905015-22-7 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C(=O)N3CCCC3)C(=O)O |
Product Overview
2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid (CAS 905015-22-7), with molecular formula C15H18N2O4S and molecular weight 322.10 g/mol. IUPAC: 2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid.
Chemical Property Profile of 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid
Property Insights of 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid
The XLogP value of 1.886 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid. The TPSA of 86.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid. Following Lipinski's Rule of Five, 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid has 2 hydrogen bond donor(s) and 4 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 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid?
The CAS number of 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid is 905015-22-7.
What is the molecular formula of 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid?
The molecular formula of 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid is C15H18N2O4S.
What is the molecular weight of 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid?
The molecular weight of 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid is 322.10 g/mol.
Where can I buy 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid?
You can request a quote for 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-oxo-2-(pyrrolidin-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.