(5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
TL;DR: (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one (CAS 904501-52-6) is a chemical compound with molecular formula C13H11NO3S2 and molecular weight 293.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one, (Z)-5-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methylene)-3-methyl-2-thioxothiazolidin-4-one
| Molecular Formula | C13H11NO3S2 |
|---|---|
| Molecular Weight | 293.02 g/mol |
| LogP | 2.2888 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 293.01804 |
| Heavy Atoms | 19 |
| Complexity | 597.55115 |
Chemical Identifiers
| CAS Number | 904501-52-6 |
|---|---|
| SMILES | CN1C(=O)/C(=C/C2=CC3=C(C=C2)OCCO3)/SC1=S |
Product Overview
(5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one (CAS 904501-52-6), with molecular formula C13H11NO3S2 and molecular weight 293.02 g/mol. IUPAC: (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Property Insights of (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
The XLogP value of 2.2888 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one. With a topological polar surface area (TPSA) of 38.77 Ų, (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one has 0 hydrogen bond donor(s) and 5 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-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one?
The CAS number of (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one is 904501-52-6.
What is the molecular formula of (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one?
The molecular formula of (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one is C13H11NO3S2.
What is the molecular weight of (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one?
The molecular weight of (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one is 293.02 g/mol.
Where can I buy (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one?
You can request a quote for (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-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-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.