![(4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione structure](/static/products/848/848765-85-5.png)
(4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
TL;DR: (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione (CAS 848765-85-5) is a chemical compound with molecular formula C25H29N3O6 and molecular weight 467.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-[2-(dimethylamino)ethyl]-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Also Known As: (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione, 1-(2-(dimethylamino)ethyl)-3-hydroxy-4-(4-isobutoxybenzoyl)-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C25H29N3O6 |
|---|---|
| Molecular Weight | 467.21 g/mol |
| LogP | 3.6129 |
| Topological Polar Surface Area | 113.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 467.20563 |
| Heavy Atoms | 34 |
| Complexity | 1107.889 |
Chemical Identifiers
| CAS Number | 848765-85-5 |
|---|---|
| SMILES | CC(C)COC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCN(C)C)C3=CC(=CC=C3)[N+](=O)[O-])/O |
Product Overview
(4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione (CAS 848765-85-5), with molecular formula C25H29N3O6 and molecular weight 467.21 g/mol. IUPAC: (4E)-1-[2-(dimethylamino)ethyl]-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Property Insights of (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
The XLogP value of 3.6129 indicates that (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.22 Ų falls within the moderate polarity range, balancing permeability and solubility for (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione. Following Lipinski's Rule of Five, (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione 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 (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione?
The CAS number of (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione is 848765-85-5.
What is the molecular formula of (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione?
The molecular formula of (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione is C25H29N3O6.
What is the molecular weight of (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione?
The molecular weight of (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione is 467.21 g/mol.
Where can I buy (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione?
You can request a quote for (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)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)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.