1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid
TL;DR: 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid (CAS 1185295-53-7) is a chemical compound with molecular formula C13H15NO4 and molecular weight 249.10011 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(4-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid
Also Known As: 1-(4-methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid, 1-[(4-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid, 1-(4-methoxybenzyl)-5-oxo-3-pyrrolidinecarboxylic acid, BAS 09589675, IDI1_029951
Technical Specifications
| Molecular Formula | C13H15NO4 |
| Molecular Weight | 249.10011 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.10011 Da |
| Heavy Atoms | 18 |
| Complexity | 323.0 |
| SMILES | COC1=CC=C(C=C1)CN2CC(CC2=O)C(=O)O |
| InChIKey | GQWNIXGHJLCLCG-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid
Property Insights of 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid. Following Lipinski's Rule of Five, 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid?
The CAS number of 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid is 1185295-53-7.
What is the molecular formula of 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid?
The molecular formula of 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid is C13H15NO4.
What is the molecular weight of 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid?
The molecular weight of 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid is 249.10011 g/mol.
Where can I buy 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid?
You can request a quote for 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 1-(4-Methoxybenzyl)-5-oxopyrrolidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.