![1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid structure](/static/products/873/87341-45-5.png)
1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid
TL;DR: 1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid (CAS 87341-45-5) is a chemical compound with molecular formula C13H15NO3 and molecular weight 233.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid
Also Known As: ChemDiv2_003461, 1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid, 1-(4-METHYLBENZYL)-5-OXOPROLINE, (S)-1-(4-Methylbenzyl)-5-oxopyrrolidine-2-carboxylic acid, 1-(4-Methylbenzyl)-5-oxopyrrolidine-2-carboxylic acid
| Molecular Formula | C13H15NO3 |
|---|---|
| Molecular Weight | 233.11 g/mol |
| LogP | 1.57062 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.1052 |
| Heavy Atoms | 17 |
| Complexity | 438.48273 |
Chemical Identifiers
| CAS Number | 87341-45-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C(CCC2=O)C(=O)O |
Product Overview
1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid (CAS 87341-45-5), with molecular formula C13H15NO3 and molecular weight 233.11 g/mol. IUPAC: 1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid.
Chemical Property Profile of 1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid
Property Insights of 1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid
The XLogP value of 1.57062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid. With a topological polar surface area (TPSA) of 57.61 Ų, 1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid has 1 hydrogen bond donor(s) and 2 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-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid?
The CAS number of 1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid is 87341-45-5.
What is the molecular formula of 1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid?
The molecular formula of 1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid is C13H15NO3.
What is the molecular weight of 1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid?
The molecular weight of 1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid is 233.11 g/mol.
Where can I buy 1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid?
You can request a quote for 1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-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-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Methylphenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.