1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid
TL;DR: 1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid (CAS 73422-90-9) is a chemical compound with molecular formula C18H17NO4 and molecular weight 311.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxylic acid
Also Known As: 1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid, 1-[4-(benzyloxy)phenyl]-5-oxo-3-pyrrolidinecarboxylic acid, 1-(4-(Benzyloxy)phenyl)-5-oxopyrrolidine-3-carboxylic acid, 5-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxylic acid, 1-[4- PHENYL]-5-OXO-3-PYRROLIDINECARBOXYLICACID
| Molecular Formula | C18H17NO4 |
|---|---|
| Molecular Weight | 311.12 g/mol |
| LogP | 2.7031 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 311.11575 |
| Heavy Atoms | 23 |
| Complexity | 696.7213 |
Chemical Identifiers
| CAS Number | 73422-90-9 |
|---|---|
| SMILES | C1C(CN(C1=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)O |
Product Overview
1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid (CAS 73422-90-9), with molecular formula C18H17NO4 and molecular weight 311.12 g/mol. IUPAC: 5-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxylic acid.
Chemical Property Profile of 1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid
Property Insights of 1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid
The XLogP value of 2.7031 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid. Following Lipinski's Rule of Five, 1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic 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-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid?
The CAS number of 1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid is 73422-90-9.
What is the molecular formula of 1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid?
The molecular formula of 1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid is C18H17NO4.
What is the molecular weight of 1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid?
The molecular weight of 1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid is 311.12 g/mol.
Where can I buy 1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid?
You can request a quote for 1-[4-(benzyloxy)phenyl]-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-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(benzyloxy)phenyl]-5-oxopyrrolidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.