(3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid
TL;DR: (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid (CAS 77519-55-2) is a chemical compound with molecular formula C11H11NO3 and molecular weight 205.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid
Also Known As: BAS 01124560, 2-oxo-4-phenylpyrrolidine-3-carboxylic acid, (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylicacid, Rel-(3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid, (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid
| Molecular Formula | C11H11NO3 |
|---|---|
| Molecular Weight | 205.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.0739 |
| Heavy Atoms | 15 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 77519-55-2 |
|---|---|
| SMILES | C1[C@@H]([C@H](C(=O)N1)C(=O)O)C2=CC=CC=C2 |
| InChIKey | UOQRZCNCICUPJO-RKDXNWHRSA-N |
Product Overview
(3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid (CAS 77519-55-2), with molecular formula C11H11NO3 and molecular weight 205.07 g/mol. IUPAC: (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid.
Chemical Property Profile of (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid
Property Insights of (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid. Following Lipinski's Rule of Five, (3R,4S)-2-oxo-4-phenylpyrrolidine-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 (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid?
The CAS number of (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid is 77519-55-2.
What is the molecular formula of (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid?
The molecular formula of (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid is C11H11NO3.
What is the molecular weight of (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid?
The molecular weight of (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid is 205.07 g/mol.
Where can I buy (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid?
You can request a quote for (3R,4S)-2-oxo-4-phenylpyrrolidine-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 (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (3R,4S)-2-oxo-4-phenylpyrrolidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.