2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid
TL;DR: 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid (CAS 53951-96-5) is a chemical compound with molecular formula C10H12ClNO4S2 and molecular weight 308.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5-piperidin-1-ylsulfonylthiophene-3-carboxylic acid
Also Known As: 2-chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid, AI-942/13331376, 2-chloro-5-piperidin-1-ylsulfonylthiophene-3-carboxylic acid, 2-Chloro-5-piperidinosulfonyl-3-thiophenecarboxylic acid, 2-chloro-5-(piperidine-1-sulfonyl)thiophene-3-carboxylic acid
| Molecular Formula | C10H12ClNO4S2 |
|---|---|
| Molecular Weight | 308.99 g/mol |
| LogP | 2.2743 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.98962 |
| Heavy Atoms | 18 |
| Complexity | 560.43286 |
Chemical Identifiers
| CAS Number | 53951-96-5 |
|---|---|
| SMILES | C1CCN(CC1)S(=O)(=O)C2=CC(=C(S2)Cl)C(=O)O |
Product Overview
2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid (CAS 53951-96-5), with molecular formula C10H12ClNO4S2 and molecular weight 308.99 g/mol. IUPAC: 2-chloro-5-piperidin-1-ylsulfonylthiophene-3-carboxylic acid.
Chemical Property Profile of 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid
Property Insights of 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid
The XLogP value of 2.2743 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid. Following Lipinski's Rule of Five, 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid has 1 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-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid?
The CAS number of 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid is 53951-96-5.
What is the molecular formula of 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid?
The molecular formula of 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid is C10H12ClNO4S2.
What is the molecular weight of 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid?
The molecular weight of 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid is 308.99 g/mol.
Where can I buy 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid?
You can request a quote for 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-5-(1-piperidinylsulfonyl)-3-thiophenecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.