(5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione structure

(5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

TL;DR: (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione (CAS 300700-45-2) is a chemical compound with molecular formula C27H32N2O5 and molecular weight 464.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

(5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

Also Known As: (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione, (5E)-3-(4-ethoxyphenyl)-6-hydroxy-5-[4-(octyloxy)benzylidene]pyrimidine-2,4(3H,5H)-dione, (E)-1-(4-ethoxyphenyl)-5-(4-(octyloxy)benzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione, 1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

CAS: 300700-45-2
Molecular Formula C27H32N2O5
Molecular Weight 464.23 g/mol
LogP 5.491
Topological Polar Surface Area 84.94 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 12
Exact Mass 464.2311
Heavy Atoms 34
Complexity 1012.3209

Chemical Identifiers

CAS Number 300700-45-2
SMILES CCCCCCCCOC1=CC=C(C=C1)/C=C/2\C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)OCC

Product Overview

(5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione (CAS 300700-45-2), with molecular formula C27H32N2O5 and molecular weight 464.23 g/mol. IUPAC: (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

XLogP
5.491
TPSA (Topological Polar Surface Area)
84.94
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
12
Heavy Atoms
34
Complexity
1012.3209
Exact Mass
464.2311
Monoisotopic Mass
464.2311
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

The XLogP value of 5.491 indicates that (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione?

The CAS number of (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione is 300700-45-2.

What is the molecular formula of (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione?

The molecular formula of (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione is C27H32N2O5.

What is the molecular weight of (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione?

The molecular weight of (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione is 464.23 g/mol.

Where can I buy (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione?

You can request a quote for (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-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)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione?

Yes, KEHONG BIO provides custom synthesis services for (5E)-1-(4-ethoxyphenyl)-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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