![(5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione structure](/static/products/862/862128-40-3.png)
(5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 862128-40-3) is a chemical compound with molecular formula C22H22N4O4S and molecular weight 438.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylphenyl)iminomethyl]-2-sulfanylidenepyrimidin-4-one
Also Known As: (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, (E)-1-(2-methoxyphenyl)-5-(((2-morpholinophenyl)amino)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C22H22N4O4S |
|---|---|
| Molecular Weight | 438.14 g/mol |
| LogP | 3.19649 |
| Topological Polar Surface Area | 92.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.13617 |
| Heavy Atoms | 31 |
| Complexity | 1228.6659 |
Chemical Identifiers
| CAS Number | 862128-40-3 |
|---|---|
| SMILES | COC1=CC=CC=C1N2C(=C(C(=O)NC2=S)C=NC3=CC=CC=C3N4CCOCC4)O |
Product Overview
(5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 862128-40-3), with molecular formula C22H22N4O4S and molecular weight 438.14 g/mol. IUPAC: 6-hydroxy-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylphenyl)iminomethyl]-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 3.19649 indicates that (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.08 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione. Following Lipinski's Rule of Five, (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione has 2 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 (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is 862128-40-3.
What is the molecular formula of (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is C22H22N4O4S.
What is the molecular weight of (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is 438.14 g/mol.
Where can I buy (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-1-(2-methoxyphenyl)-5-[(2-morpholin-4-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.