![2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid structure](/static/products/2201/220128-11-0.webp)
2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid
TL;DR: 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid (CAS 220128-11-0) is a chemical compound with molecular formula C14H13NO5 and molecular weight 275.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid
Also Known As: BAS 00805040, (3-acetyl-4-hydroxy-5-oxo-2-phenyl-2,5-dihydro-pyrrol-1-yl)acetic acid, 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid
| Molecular Formula | C14H13NO5 |
|---|---|
| Molecular Weight | 275.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 94.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 275.07938 |
| Heavy Atoms | 20 |
| Complexity | 476.0 |
Chemical Identifiers
| CAS Number | 220128-11-0 |
|---|---|
| SMILES | CC(=O)C1=C(C(=O)N([C@H]1C2=CC=CC=C2)CC(=O)O)O |
| InChIKey | MGJBYEARFYIWTC-LBPRGKRZSA-N |
Product Overview
2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid (CAS 220128-11-0), with molecular formula C14H13NO5 and molecular weight 275.08 g/mol. IUPAC: 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid.
Chemical Property Profile of 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid
Property Insights of 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid. The TPSA of 94.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid. Following Lipinski's Rule of Five, 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid has 2 hydrogen bond donor(s) and 5 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 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid?
The CAS number of 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid is 220128-11-0.
What is the molecular formula of 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid?
The molecular formula of 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid is C14H13NO5.
What is the molecular weight of 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid?
The molecular weight of 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid is 275.08 g/mol.
Where can I buy 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid?
You can request a quote for 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.