(5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one
TL;DR: (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one (CAS 896835-66-8) is a chemical compound with molecular formula C19H11NO4S2 and molecular weight 381.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[2-(1,3-benzodioxol-5-yl)chromen-4-ylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one, (5Z)-5-[2-(1,3-benzodioxol-5-yl)chromen-4-ylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, (Z)-5-(2-(benzo[d][1,3]dioxol-5-yl)-4H-chromen-4-ylidene)-2-thioxothiazolidin-4-one
| Molecular Formula | C19H11NO4S2 |
|---|---|
| Molecular Weight | 381.01 g/mol |
| LogP | 3.7078 |
| Topological Polar Surface Area | 56.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 381.01294 |
| Heavy Atoms | 26 |
| Complexity | 1041.5847 |
Chemical Identifiers
| CAS Number | 896835-66-8 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C3=C/C(=C/4\C(=O)NC(=S)S4)/C5=CC=CC=C5O3 |
Product Overview
(5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one (CAS 896835-66-8), with molecular formula C19H11NO4S2 and molecular weight 381.01 g/mol. IUPAC: (5Z)-5-[2-(1,3-benzodioxol-5-yl)chromen-4-ylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one
Property Insights of (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one
The XLogP value of 3.7078 indicates that (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.79 Ų, (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one has 1 hydrogen bond donor(s) and 6 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 (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one?
The CAS number of (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one is 896835-66-8.
What is the molecular formula of (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one?
The molecular formula of (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one is C19H11NO4S2.
What is the molecular weight of (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one?
The molecular weight of (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one is 381.01 g/mol.
Where can I buy (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one?
You can request a quote for (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-5-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-thioxo-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.