1-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid
TL;DR: 1-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid (CAS 885953-76-4) is a chemical compound with molecular formula C12H12N2O4 and molecular weight 248.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid
Also Known As: 1-(4-carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid, 1-[4-(aminocarbonyl)phenyl]-5-oxopyrrolidine-3-carboxylic acid, 1-(4-carbamoylphenyl)-5-oxo-pyrrolidine-3-carboxylic Acid, 1-(4-carbamoylphenyl)-5-oxopyrrolidine-3-carboxylicacid, 3-pyrrolidinecarboxylic acid, 1-[4-(aminocarbonyl)phenyl]-5-oxo-
| Molecular Formula | C12H12N2O4 |
|---|---|
| Molecular Weight | 248.08 g/mol |
| LogP | 0.223 |
| Topological Polar Surface Area | 100.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.07971 |
| Heavy Atoms | 18 |
| Complexity | 509.31363 |
Chemical Identifiers
| CAS Number | 885953-76-4 |
|---|---|
| SMILES | C1C(CN(C1=O)C2=CC=C(C=C2)C(=O)N)C(=O)O |
Product Overview
1-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid (CAS 885953-76-4), with molecular formula C12H12N2O4 and molecular weight 248.08 g/mol. IUPAC: 1-(4-carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid.
Chemical Property Profile of 1-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid
Property Insights of 1-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid
The XLogP value of 0.223 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid. The TPSA of 100.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid. Following Lipinski's Rule of Five, 1-(4-Carbamoylphenyl)-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-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid?
The CAS number of 1-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid is 885953-76-4.
What is the molecular formula of 1-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid?
The molecular formula of 1-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid is C12H12N2O4.
What is the molecular weight of 1-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid?
The molecular weight of 1-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid is 248.08 g/mol.
Where can I buy 1-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid?
You can request a quote for 1-(4-Carbamoylphenyl)-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-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Carbamoylphenyl)-5-oxopyrrolidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.