![(Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one structure](/static/products/840/840470-40-8.png)
(Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
TL;DR: (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one (CAS 840470-40-8) is a chemical compound with molecular formula C21H17IN4O2S and molecular weight 516.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7Z)-7-(5,7-dimethyl-2-oxo-1H-indol-3-ylidene)-3-(4-iodophenyl)-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one
Also Known As: (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one, (7Z)-7-(5,7-dimethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one, (7Z)-7-(5,7-dimethyl-2-oxo-1H-indol-3-ylidene)-3-(4-iodophenyl)-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one
| Molecular Formula | C21H17IN4O2S |
|---|---|
| Molecular Weight | 516.01 g/mol |
| LogP | 2.33714 |
| Topological Polar Surface Area | 66.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 516.0117 |
| Heavy Atoms | 29 |
| Complexity | 1355.0436 |
Chemical Identifiers
| CAS Number | 840470-40-8 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)/C(=C/3\C(=O)N4CN(CN=C4S3)C5=CC=C(C=C5)I)/C(=O)N2)C |
Product Overview
(Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one (CAS 840470-40-8), with molecular formula C21H17IN4O2S and molecular weight 516.01 g/mol. IUPAC: (7Z)-7-(5,7-dimethyl-2-oxo-1H-indol-3-ylidene)-3-(4-iodophenyl)-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one.
Chemical Property Profile of (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Property Insights of (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
The XLogP value of 2.33714 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one. The TPSA of 66.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one. Following Lipinski's Rule of Five, (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one?
The CAS number of (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one is 840470-40-8.
What is the molecular formula of (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one?
The molecular formula of (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one is C21H17IN4O2S.
What is the molecular weight of (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one?
The molecular weight of (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one is 516.01 g/mol.
Where can I buy (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one?
You can request a quote for (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-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)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-7-(5,7-dimethyl-2-oxoindolin-3-ylidene)-3-(4-iodophenyl)-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.