![5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione structure](/static/products/300/300586-56-5.png)
5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione
TL;DR: 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione (CAS 300586-56-5) is a chemical compound with molecular formula C23H32N2O4 and molecular weight 400.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-1-tert-butyl-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione, (5E)-1-tert-butyl-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione, (5E)-3-tert-butyl-6-hydroxy-5-[4-(octyloxy)benzylidene]pyrimidine-2,4(3H,5H)-dione, (E)-1-(tert-butyl)-5-(4-(octyloxy)benzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C23H32N2O4 |
|---|---|
| Molecular Weight | 400.24 g/mol |
| LogP | 4.6862 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 400.2362 |
| Heavy Atoms | 29 |
| Complexity | 760.0777 |
Chemical Identifiers
| CAS Number | 300586-56-5 |
|---|---|
| SMILES | CCCCCCCCOC1=CC=C(C=C1)/C=C/2\C(=O)NC(=O)N(C2=O)C(C)(C)C |
Product Overview
5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione (CAS 300586-56-5), with molecular formula C23H32N2O4 and molecular weight 400.24 g/mol. IUPAC: (5E)-1-tert-butyl-5-[(4-octoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione
Property Insights of 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione
The XLogP value of 4.6862 indicates that 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione has 1 hydrogen bond donor(s) and 4 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 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione?
The CAS number of 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione is 300586-56-5.
What is the molecular formula of 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione is C23H32N2O4.
What is the molecular weight of 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione is 400.24 g/mol.
Where can I buy 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-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 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-octoxyphenyl)methylidene]-1-tert-butyl-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.