5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one
TL;DR: 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one (CAS 100054-76-0) is a chemical compound with molecular formula C11H17NOS2 and molecular weight 243.07515 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-(1-methyl-heptylidene)-2-thioxo-thiazolidin-4-one, 5-octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one
Technical Specifications
| Molecular Formula | C11H17NOS2 |
| Molecular Weight | 243.07515 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 86.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 243.07515 Da |
| Heavy Atoms | 15 |
| Complexity | 297.0 |
| SMILES | CCCCCCC(=C1C(=O)NC(=S)S1)C |
| InChIKey | BACSRAZDDCGUQS-UHFFFAOYSA-N |
Chemical Property Profile of 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one
Property Insights of 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one
The XLogP value of 4.8 indicates that 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one. Following Lipinski's Rule of Five, 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one?
The CAS number of 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one is 100054-76-0.
What is the molecular formula of 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one?
The molecular formula of 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one is C11H17NOS2.
What is the molecular weight of 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one?
The molecular weight of 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one is 243.07515 g/mol.
Where can I buy 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one?
You can request a quote for 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one?
Yes, CoreyChem provides custom synthesis services for 5-Octan-2-ylidene-2-sulfanylidene-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.