![(Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one structure](/static/products/840/840468-95-3.png)
(Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
TL;DR: (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one (CAS 840468-95-3) is a chemical compound with molecular formula C21H20IN3O4S and molecular weight 537.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7Z)-3-(4-iodophenyl)-7-[(3,4,5-trimethoxyphenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one
Also Known As: (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one, (7Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one, (7Z)-3-(4-iodophenyl)-7-[(3,4,5-trimethoxyphenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one
| Molecular Formula | C21H20IN3O4S |
|---|---|
| Molecular Weight | 537.02 g/mol |
| LogP | 2.4238 |
| Topological Polar Surface Area | 65.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 537.0219 |
| Heavy Atoms | 30 |
| Complexity | 1225.7314 |
Chemical Identifiers
| CAS Number | 840468-95-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)/C=C\2/C(=O)N3CN(CN=C3S2)C4=CC=C(C=C4)I |
Product Overview
(Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one (CAS 840468-95-3), with molecular formula C21H20IN3O4S and molecular weight 537.02 g/mol. IUPAC: (7Z)-3-(4-iodophenyl)-7-[(3,4,5-trimethoxyphenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one.
Chemical Property Profile of (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Property Insights of (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
The XLogP value of 2.4238 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one. The TPSA of 65.29 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one. Following Lipinski's Rule of Five, (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one has 0 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 (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one?
The CAS number of (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one is 840468-95-3.
What is the molecular formula of (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one?
The molecular formula of (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one is C21H20IN3O4S.
What is the molecular weight of (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one?
The molecular weight of (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one is 537.02 g/mol.
Where can I buy (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one?
You can request a quote for (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-(4-iodophenyl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.