![(5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione structure](/static/products/714/714253-30-2.png)
(5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione
TL;DR: (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione (CAS 714253-30-2) is a chemical compound with molecular formula C28H20FN3O7 and molecular weight 529.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione
Also Known As: (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione, (E)-5-(5-((1,3-dioxoisoindolin-2-yl)methyl)-2,4-dimethoxybenzylidene)-1-(4-fluorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione, 2-(5-{(E)-[1-(4-fluorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-2,4-dimethoxybenzyl)-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C28H20FN3O7 |
|---|---|
| Molecular Weight | 529.13 g/mol |
| LogP | 3.3055 |
| Topological Polar Surface Area | 122.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 529.12854 |
| Heavy Atoms | 39 |
| Complexity | 1562.135 |
Chemical Identifiers
| CAS Number | 714253-30-2 |
|---|---|
| SMILES | COC1=CC(=C(C=C1CN2C(=O)C3=CC=CC=C3C2=O)/C=C/4\C(=O)NC(=O)N(C4=O)C5=CC=C(C=C5)F)OC |
Product Overview
(5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione (CAS 714253-30-2), with molecular formula C28H20FN3O7 and molecular weight 529.13 g/mol. IUPAC: (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione
Property Insights of (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione
The XLogP value of 3.3055 indicates that (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.32 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione 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 (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione?
The CAS number of (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione is 714253-30-2.
What is the molecular formula of (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione?
The molecular formula of (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione is C28H20FN3O7.
What is the molecular weight of (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione?
The molecular weight of (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione is 529.13 g/mol.
Where can I buy (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione?
You can request a quote for (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-5-[[5-[(1,3-dioxoisoindol-2-yl)methyl]-2,4-dimethoxyphenyl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.