Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate
TL;DR: Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate (CAS 1049756-11-7) is a chemical compound with molecular formula C8H4ClKN2S3 and molecular weight 297.88623 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
potassium 4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazole-2-thiolate
Also Known As: potassium [4-(4-chlorophenyl)-5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl]sulfanide, potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate, Potassium 4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazole-2-thiolate, potassium;4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazole-2-thiolate, 3-(4-chlorophenyl)-5-sulfanyl-1,3,4-thiadiazoline-2-thione, potassium salt
Technical Specifications
| Molecular Formula | C8H4ClKN2S3 |
| Molecular Weight | 297.88623 g/mol |
| XLogP | 0.22649 |
| Topological Polar Surface Area (TPSA) | 74.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 297.88623 Da |
| Heavy Atoms | 15 |
| Complexity | 279.0 |
| SMILES | C1=CC(=CC=C1N2C(=S)SC(=N2)[S-])Cl.[K+] |
| InChIKey | XCEOAPZXOOBMHD-UHFFFAOYSA-M |
Chemical Property Profile of Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate
Property Insights of Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate
The XLogP value of 0.22649 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate. The TPSA of 74.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate. Following Lipinski's Rule of Five, Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate 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 Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate?
The CAS number of Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate is 1049756-11-7.
What is the molecular formula of Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate?
The molecular formula of Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate is C8H4ClKN2S3.
What is the molecular weight of Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate?
The molecular weight of Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate is 297.88623 g/mol.
Where can I buy Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate?
You can request a quote for Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate?
Yes, CoreyChem provides custom synthesis services for Potassium 4-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazole-2-thiolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.