![1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid structure](/static/products/849/849440-93-3.png)
1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid
TL;DR: 1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid (CAS 849440-93-3) is a chemical compound with molecular formula C14H18N2O5S and molecular weight 326.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[(4-methylphenyl)sulfonylamino]acetyl]pyrrolidine-2-carboxylic acid
Also Known As: Tosylglycylproline, Tos-Gly-Pro-OH, N-[(4-methylphenyl)sulfonyl]glycylproline, L-Proline, N-[(4-methylphenyl)sulfonyl]glycyl-, (S)-1-(2-(4-Methylphenylsulfonamido)acetyl)pyrrolidine-2-carboxylic acid
| Molecular Formula | C14H18N2O5S |
|---|---|
| Molecular Weight | 326.09 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.09363 |
| Heavy Atoms | 22 |
| Complexity | 520.0 |
Chemical Identifiers
| CAS Number | 849440-93-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)N2CCCC2C(=O)O |
| InChIKey | PKLPIXGPPLQAQK-UHFFFAOYSA-N |
Product Overview
1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid (CAS 849440-93-3), with molecular formula C14H18N2O5S and molecular weight 326.09 g/mol. IUPAC: 1-[2-[(4-methylphenyl)sulfonylamino]acetyl]pyrrolidine-2-carboxylic acid.
Chemical Property Profile of 1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid
Property Insights of 1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid. Following Lipinski's Rule of Five, 1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid has 2 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 1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid?
The CAS number of 1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid is 849440-93-3.
What is the molecular formula of 1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid?
The molecular formula of 1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid is C14H18N2O5S.
What is the molecular weight of 1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid?
The molecular weight of 1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid is 326.09 g/mol.
Where can I buy 1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid?
You can request a quote for 1-[2-(4-Methylbenzenesulfonamido)acetyl]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-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(4-Methylbenzenesulfonamido)acetyl]pyrrolidine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.