1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid
TL;DR: 1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid (CAS 370883-85-5) is a chemical compound with molecular formula C12H15NO4S and molecular weight 269.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylic acid
Also Known As: tosylproline, TOSYL-D-PROLINE, Tos-Pro-OH, Difenidol, n-tosylproline
| Molecular Formula | C12H15NO4S |
|---|---|
| Molecular Weight | 269.07 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.07217 |
| Heavy Atoms | 18 |
| Complexity | 406.0 |
Chemical Identifiers
| CAS Number | 370883-85-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)O |
| InChIKey | CGPHGPCHVUSFFA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid (CAS 370883-85-5), with molecular formula C12H15NO4S and molecular weight 269.07 g/mol. IUPAC: 1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylic acid.
Chemical Property Profile of 1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid
Property Insights of 1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid. Following Lipinski's Rule of Five, 1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid has 1 hydrogen bond donor(s) and 5 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-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid?
The CAS number of 1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid is 370883-85-5.
What is the molecular formula of 1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid?
The molecular formula of 1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid is C12H15NO4S.
What is the molecular weight of 1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid?
The molecular weight of 1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid is 269.07 g/mol.
Where can I buy 1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid?
You can request a quote for 1-(Toluene-4-sulfonyl)-pyrrolidine-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 1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(Toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.