![1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid structure](/static/products/879/879405-89-7.png)
1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid
TL;DR: 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid (CAS 879405-89-7) is a chemical compound with molecular formula C16H23NO4S and molecular weight 325.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-tert-butylphenyl)sulfonylpiperidine-2-carboxylic acid
Also Known As: ChemDiv2_002716, 1-(4-tert-butylbenzenesulfonyl)piperidine-2-carboxylic acid, 1-[(4-tert-butylphenyl)sulfonyl]piperidine-2-carboxylic acid, 1-(4-tert-butylphenyl)sulfonylpiperidine-2-carboxylic acid, 1-[(4-TERT-BUTYLBENZENE)SULFONYL]PIPERIDINE-2-CARBOXYLIC ACID
| Molecular Formula | C16H23NO4S |
|---|---|
| Molecular Weight | 325.13 g/mol |
| LogP | 2.6119 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.13477 |
| Heavy Atoms | 22 |
| Complexity | 643.7185 |
Chemical Identifiers
| CAS Number | 879405-89-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)O |
Product Overview
1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid (CAS 879405-89-7), with molecular formula C16H23NO4S and molecular weight 325.13 g/mol. IUPAC: 1-(4-tert-butylphenyl)sulfonylpiperidine-2-carboxylic acid.
Chemical Property Profile of 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid
Property Insights of 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid
The XLogP value of 2.6119 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid. Following Lipinski's Rule of Five, 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid has 1 hydrogen bond donor(s) and 3 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-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid?
The CAS number of 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid is 879405-89-7.
What is the molecular formula of 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid?
The molecular formula of 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid is C16H23NO4S.
What is the molecular weight of 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid?
The molecular weight of 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid is 325.13 g/mol.
Where can I buy 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid?
You can request a quote for 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-piperidinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.