3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one
TL;DR: 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one (CAS 1164535-87-8) is a chemical compound with molecular formula C15H11NO2S2 and molecular weight 301.02313 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5E)-3-benzyl-5-(furan-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 00572252, BIM-0023456.P001, 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one, AB00088538-01, (5E)-3-benzyl-5-(furan-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Technical Specifications
| Molecular Formula | C15H11NO2S2 |
| Molecular Weight | 301.02313 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 90.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.02313 Da |
| Heavy Atoms | 20 |
| Complexity | 430.0 |
| SMILES | C1=CC=C(C=C1)CN2C(=O)/C(=C\C3=CC=CO3)/SC2=S |
| InChIKey | AWTLVOFTBSNDPK-UKTHLTGXSA-N |
Chemical Property Profile of 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one
Property Insights of 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one
The XLogP value of 3.6 indicates that 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one. Following Lipinski's Rule of Five, 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one?
The CAS number of 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one is 1164535-87-8.
What is the molecular formula of 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one?
The molecular formula of 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one is C15H11NO2S2.
What is the molecular weight of 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one?
The molecular weight of 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one is 301.02313 g/mol.
Where can I buy 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one?
You can request a quote for 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one?
Yes, CoreyChem provides custom synthesis services for 3-Benzyl-5-furan-2-ylmethylene-2-thioxo-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.