Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid
TL;DR: Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid (CAS 1784747-95-0) is a chemical compound with molecular formula C12H13NO4 and molecular weight 235.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid
Also Known As: BAS 01088762, Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid, (3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid
| Molecular Formula | C12H13NO4 |
|---|---|
| Molecular Weight | 235.08 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.08446 |
| Heavy Atoms | 17 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 1784747-95-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)[C@H]2CNC(=O)[C@@H]2C(=O)O |
| InChIKey | WJNJYUONVAQWHY-NXEZZACHSA-N |
Product Overview
Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid (CAS 1784747-95-0), with molecular formula C12H13NO4 and molecular weight 235.08 g/mol. IUPAC: (3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid.
Chemical Property Profile of Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid
Property Insights of Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid. Following Lipinski's Rule of Five, Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid has 2 hydrogen bond donor(s) and 4 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 Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid?
The CAS number of Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid is 1784747-95-0.
What is the molecular formula of Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid?
The molecular formula of Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid is C12H13NO4.
What is the molecular weight of Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid?
The molecular weight of Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid is 235.08 g/mol.
Where can I buy Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid?
You can request a quote for Rel-(3R,4S)-4-(4-methoxyphenyl)-2-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 Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for Rel-(3R,4S)-4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.