![(4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione structure](/static/products/840/840455-22-3.png)
(4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione
TL;DR: (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione (CAS 840455-22-3) is a chemical compound with molecular formula C31H26N2O5S and molecular weight 538.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-[hydroxy-[4-[(3-methylphenyl)methoxy]phenyl]methylidene]-5-phenylpyrrolidine-2,3-dione
Also Known As: (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione, (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-[hydroxy-[4-[(3-methylphenyl)methoxy]phenyl]methylidene]-5-phenylpyrrolidine-2,3-dione, 1-(5-acetyl-4-methylthiazol-2-yl)-3-hydroxy-4-(4-((3-methylbenzyl)oxy)benzoyl)-5-phenyl-1H-pyrrol-2(5H)-one
| Molecular Formula | C31H26N2O5S |
|---|---|
| Molecular Weight | 538.16 g/mol |
| LogP | 6.16784 |
| Topological Polar Surface Area | 96.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 538.15625 |
| Heavy Atoms | 39 |
| Complexity | 1605.7007 |
Chemical Identifiers
| CAS Number | 840455-22-3 |
|---|---|
| SMILES | CC1=CC(=CC=C1)COC2=CC=C(C=C2)/C(=C\3/C(N(C(=O)C3=O)C4=NC(=C(S4)C(=O)C)C)C5=CC=CC=C5)/O |
Product Overview
(4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione (CAS 840455-22-3), with molecular formula C31H26N2O5S and molecular weight 538.16 g/mol. IUPAC: (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-[hydroxy-[4-[(3-methylphenyl)methoxy]phenyl]methylidene]-5-phenylpyrrolidine-2,3-dione.
Chemical Property Profile of (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione
Property Insights of (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione
The XLogP value of 6.16784 indicates that (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione. Following Lipinski's Rule of Five, (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione?
The CAS number of (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione is 840455-22-3.
What is the molecular formula of (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione?
The molecular formula of (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione is C31H26N2O5S.
What is the molecular weight of (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione?
The molecular weight of (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione is 538.16 g/mol.
Where can I buy (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione?
You can request a quote for (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-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-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenylpyrrolidine-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.