(4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
TL;DR: (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione (CAS 618368-36-8) is a chemical compound with molecular formula C25H17ClN2O4 and molecular weight 444.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-benzofuran-2-carbonyl)-2-(3-chlorophenyl)-4-hydroxy-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one
Also Known As: (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione, 3-(1-benzofuran-2-carbonyl)-2-(3-chlorophenyl)-4-hydroxy-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one, 4-(benzofuran-2-carbonyl)-5-(3-chlorophenyl)-3-hydroxy-1-(pyridin-3-ylmethyl)-1H-pyrrol-2(5H)-one, 4-(benzofuran-2-carbonyl)-5-(3-chlorophenyl)-3-hydroxy-1-(pyridin-3-ylmethyl)-5H-pyrrol-2-one
| Molecular Formula | C25H17ClN2O4 |
|---|---|
| Molecular Weight | 444.09 g/mol |
| LogP | 5.2597 |
| Topological Polar Surface Area | 83.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 444.08768 |
| Heavy Atoms | 32 |
| Complexity | 1343.9929 |
Chemical Identifiers
| CAS Number | 618368-36-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(O2)C(=O)C3=C(C(=O)N(C3C4=CC(=CC=C4)Cl)CC5=CN=CC=C5)O |
Product Overview
(4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione (CAS 618368-36-8), with molecular formula C25H17ClN2O4 and molecular weight 444.09 g/mol. IUPAC: 3-(1-benzofuran-2-carbonyl)-2-(3-chlorophenyl)-4-hydroxy-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one.
Chemical Property Profile of (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Property Insights of (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
The XLogP value of 5.2597 indicates that (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.64 Ų falls within the moderate polarity range, balancing permeability and solubility for (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione. Following Lipinski's Rule of Five, (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione?
The CAS number of (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione is 618368-36-8.
What is the molecular formula of (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione?
The molecular formula of (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione is C25H17ClN2O4.
What is the molecular weight of (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione?
The molecular weight of (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione is 444.09 g/mol.
Where can I buy (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione?
You can request a quote for (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3-chlorophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.