1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid
TL;DR: 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid (CAS 899703-25-4) is a chemical compound with molecular formula C9H13N3O4S and molecular weight 259.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxylic acid
Also Known As: 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid, 2,5,6-Trifluoro-nicotinicacid, 1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxylic acid, 1-(1H-imidazole-4-sulfonyl)piperidine-3-carboxylic acid, 5-(2-Butoxy-phenyl)-2H-pyrazole-3-carboxylic acid
| Molecular Formula | C9H13N3O4S |
|---|---|
| Molecular Weight | 259.06 g/mol |
| LogP | -0.105 |
| Topological Polar Surface Area | 103.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.06268 |
| Heavy Atoms | 17 |
| Complexity | 496.32047 |
Chemical Identifiers
| CAS Number | 899703-25-4 |
|---|---|
| SMILES | C1CC(CN(C1)S(=O)(=O)C2=CN=CN2)C(=O)O |
Product Overview
1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid (CAS 899703-25-4), with molecular formula C9H13N3O4S and molecular weight 259.06 g/mol. IUPAC: 1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxylic acid.
Chemical Property Profile of 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid
Property Insights of 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid
The XLogP value of -0.105 indicates that 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid. Following Lipinski's Rule of Five, 1-(1H-imidazol-4-ylsulfonyl)piperidine-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 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid?
The CAS number of 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid is 899703-25-4.
What is the molecular formula of 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid?
The molecular formula of 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid is C9H13N3O4S.
What is the molecular weight of 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid?
The molecular weight of 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid is 259.06 g/mol.
Where can I buy 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid?
You can request a quote for 1-(1H-imidazol-4-ylsulfonyl)piperidine-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 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(1H-imidazol-4-ylsulfonyl)piperidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.