1-Anilino-5-oxopyrrolidine-3-carboxylic acid
TL;DR: 1-Anilino-5-oxopyrrolidine-3-carboxylic acid (CAS 39629-94-2) is a chemical compound with molecular formula C11H12N2O3 and molecular weight 220.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-anilino-5-oxopyrrolidine-3-carboxylic acid
Also Known As: 1-anilino-5-oxopyrrolidine-3-carboxylic acid, 5-oxo-1-(phenylamino)pyrrolidine-3-carboxylic acid, 1-Anilino-5-oxo-pyrrolidin-3-carbonsaeure, 1-anilino-5-oxo-3-pyrrolidinecarboxylic acid, 1-anilino-5-oxo-pyrrolidine-3-carboxylic acid
| Molecular Formula | C11H12N2O3 |
|---|---|
| Molecular Weight | 220.08 g/mol |
| LogP | 0.9466 |
| Topological Polar Surface Area | 69.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 220.0848 |
| Heavy Atoms | 16 |
| Complexity | 404.95053 |
Chemical Identifiers
| CAS Number | 39629-94-2 |
|---|---|
| SMILES | C1C(CN(C1=O)NC2=CC=CC=C2)C(=O)O |
Product Overview
1-Anilino-5-oxopyrrolidine-3-carboxylic acid (CAS 39629-94-2), with molecular formula C11H12N2O3 and molecular weight 220.08 g/mol. IUPAC: 1-anilino-5-oxopyrrolidine-3-carboxylic acid.
Chemical Property Profile of 1-Anilino-5-oxopyrrolidine-3-carboxylic acid
Property Insights of 1-Anilino-5-oxopyrrolidine-3-carboxylic acid
The XLogP value of 0.9466 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Anilino-5-oxopyrrolidine-3-carboxylic acid. The TPSA of 69.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Anilino-5-oxopyrrolidine-3-carboxylic acid. Following Lipinski's Rule of Five, 1-Anilino-5-oxopyrrolidine-3-carboxylic acid has 2 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-Anilino-5-oxopyrrolidine-3-carboxylic acid?
The CAS number of 1-Anilino-5-oxopyrrolidine-3-carboxylic acid is 39629-94-2.
What is the molecular formula of 1-Anilino-5-oxopyrrolidine-3-carboxylic acid?
The molecular formula of 1-Anilino-5-oxopyrrolidine-3-carboxylic acid is C11H12N2O3.
What is the molecular weight of 1-Anilino-5-oxopyrrolidine-3-carboxylic acid?
The molecular weight of 1-Anilino-5-oxopyrrolidine-3-carboxylic acid is 220.08 g/mol.
Where can I buy 1-Anilino-5-oxopyrrolidine-3-carboxylic acid?
You can request a quote for 1-Anilino-5-oxopyrrolidine-3-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-Anilino-5-oxopyrrolidine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-Anilino-5-oxopyrrolidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.