(2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli
TL;DR: (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli (CAS 54255-34-4) is a chemical compound with molecular formula C12H8N2O2S3 and molecular weight 307.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-4H-1,4-benzothiazin-3-one
Also Known As: (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli, 2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-4H-1,4-benzothiazin-3-one
| Molecular Formula | C12H8N2O2S3 |
|---|---|
| Molecular Weight | 307.97 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 307.9748 |
| Heavy Atoms | 19 |
| Complexity | 503.0 |
Chemical Identifiers
| CAS Number | 54255-34-4 |
|---|---|
| SMILES | CN1C(=O)C(=C2C(=O)NC3=CC=CC=C3S2)SC1=S |
| InChIKey | SWHNSEPURZKWGI-UHFFFAOYSA-N |
Product Overview
(2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli (CAS 54255-34-4), with molecular formula C12H8N2O2S3 and molecular weight 307.97 g/mol. IUPAC: 2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-4H-1,4-benzothiazin-3-one.
Chemical Property Profile of (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli
Property Insights of (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli. Following Lipinski's Rule of Five, (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli has 1 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 (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli?
The CAS number of (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli is 54255-34-4.
What is the molecular formula of (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli?
The molecular formula of (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli is C12H8N2O2S3.
What is the molecular weight of (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli?
The molecular weight of (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli is 307.97 g/mol.
Where can I buy (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli?
You can request a quote for (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yli and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.