4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid
TL;DR: 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid (CAS 446029-57-8) is a chemical compound with molecular formula C9H11NO4S2 and molecular weight 261.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-pyrrolidin-1-ylsulfonylthiophene-2-carboxylic acid
Also Known As: 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid, 4-pyrrolidin-1-ylsulfonylthiophene-2-carboxylic acid, 4-(Pyrrolidine-1-sulfonyl)-thiophene-2-carboxylic acid, 4-(pyrrolidinylsulfonyl)thiophene-2-carboxylic acid, A2801/0118381
| Molecular Formula | C9H11NO4S2 |
|---|---|
| Molecular Weight | 261.01 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.01294 |
| Heavy Atoms | 16 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 446029-57-8 |
|---|---|
| SMILES | C1CCN(C1)S(=O)(=O)C2=CSC(=C2)C(=O)O |
| InChIKey | URMZBSZJPVHQGB-UHFFFAOYSA-N |
Product Overview
4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid (CAS 446029-57-8), with molecular formula C9H11NO4S2 and molecular weight 261.01 g/mol. IUPAC: 4-pyrrolidin-1-ylsulfonylthiophene-2-carboxylic acid.
Chemical Property Profile of 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid
Property Insights of 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid. Following Lipinski's Rule of Five, 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid has 1 hydrogen bond donor(s) and 6 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 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid?
The CAS number of 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid is 446029-57-8.
What is the molecular formula of 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid?
The molecular formula of 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid is C9H11NO4S2.
What is the molecular weight of 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid?
The molecular weight of 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid is 261.01 g/mol.
Where can I buy 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid?
You can request a quote for 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.