![(2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid structure](/static/products/1984/198414-08-3.webp)
(2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid
TL;DR: (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid (CAS 198414-08-3) is a chemical compound with molecular formula C23H17NO7 and molecular weight 419.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(5E)-2-(furan-2-yl)-5-(furan-2-ylmethylidene)-3-[(E)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]-4-oxopyrrol-1-yl]propanoic acid
Also Known As: (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid, (2S)-2-[(2E)-5-(furan-2-yl)-4-[(1E)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]-2-[(furan-2-yl)methylidene]-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]propanoic acid, (2S)-2-[(5E)-2-(furan-2-yl)-5-(furan-2-ylmethylidene)-3-[(E)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]-4-oxopyrrol-1-yl]propanoic acid, (alphaS)-alpha-Methyl-2,3-dihydro-2-[(alphaE)-furfurylidene]-3-oxo-4-[(1E)-1-formyl-2-(2-furyl)vinyl]-5-(2-furyl)-1H-pyrrole-1-acetic acid, (alphaS,2E)-alpha-Methyl-2-(2-furylmethylene)-3-oxo-4-[(E)-1-formyl-2-(2-furyl)ethenyl]-5-(2-furyl)-2,3-dihydro-1H-pyrrole-1-acetic acid
| Molecular Formula | C23H17NO7 |
|---|---|
| Molecular Weight | 419.10 g/mol |
| LogP | 3.8581 |
| Topological Polar Surface Area | 114.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 419.1005 |
| Heavy Atoms | 31 |
| Complexity | 1192.9323 |
Chemical Identifiers
| CAS Number | 198414-08-3 |
|---|---|
| SMILES | C[C@@H](C(=O)O)N1/C(=C/C2=CC=CO2)/C(=O)C(=C1C3=CC=CO3)/C(=C\C4=CC=CO4)/C=O |
Product Overview
(2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid (CAS 198414-08-3), with molecular formula C23H17NO7 and molecular weight 419.10 g/mol. IUPAC: (2S)-2-[(5E)-2-(furan-2-yl)-5-(furan-2-ylmethylidene)-3-[(E)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]-4-oxopyrrol-1-yl]propanoic acid.
Chemical Property Profile of (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid
Property Insights of (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid
The XLogP value of 3.8581 indicates that (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid. Following Lipinski's Rule of Five, (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid has 1 hydrogen bond donor(s) and 7 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 (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid?
The CAS number of (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid is 198414-08-3.
What is the molecular formula of (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid?
The molecular formula of (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid is C23H17NO7.
What is the molecular weight of (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid?
The molecular weight of (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid is 419.10 g/mol.
Where can I buy (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid?
You can request a quote for (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-[2-(2-Furyl)-3-[(E)-1-formyl-2-(2-furyl)ethenyl]-4-oxo-5-[(E)-(2-furyl)methylene]-2-pyrroline-1-yl]propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.