1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid
TL;DR: 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (CAS 63674-59-9) is a chemical compound with molecular formula C15H19NO4 and molecular weight 277.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-butoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid
Also Known As: 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid, 1-(4-butoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid, A2205/0092859
| Molecular Formula | C15H19NO4 |
|---|---|
| Molecular Weight | 277.13 g/mol |
| LogP | 2.303 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 277.1314 |
| Heavy Atoms | 20 |
| Complexity | 483.15182 |
Chemical Identifiers
| CAS Number | 63674-59-9 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)O |
Product Overview
1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (CAS 63674-59-9), with molecular formula C15H19NO4 and molecular weight 277.13 g/mol. IUPAC: 1-(4-butoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid.
Chemical Property Profile of 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid
Property Insights of 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid
The XLogP value of 2.303 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid. Following Lipinski's Rule of Five, 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid has 1 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-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid?
The CAS number of 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid is 63674-59-9.
What is the molecular formula of 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid?
The molecular formula of 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid is C15H19NO4.
What is the molecular weight of 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid?
The molecular weight of 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid is 277.13 g/mol.
Where can I buy 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid?
You can request a quote for 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic 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-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Butoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.