1,1'-Oxalylbis-3-thiosemicarbazide
TL;DR: 1,1'-Oxalylbis-3-thiosemicarbazide (CAS 116974-17-5) is a chemical compound with molecular formula C4H8N6O2S2 and molecular weight 236.01501 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[[2-(2-carbamothioylhydrazinyl)-2-oxoacetyl]amino]thiourea
Also Known As: oxalyl dithiosemicarbazide, 1,1'-Oxalylbis-3-thiosemicarbazide, 2,2'-oxalylbis(hydrazinecarbothioamide), [[2-(2-carbamothioylhydrazinyl)-2-oxoacetyl]amino]thiourea
Technical Specifications
| Molecular Formula | C4H8N6O2S2 |
| Molecular Weight | 236.01501 g/mol |
| XLogP | -0.6 |
| Topological Polar Surface Area (TPSA) | 198.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 236.01501 Da |
| Heavy Atoms | 14 |
| Complexity | 251.0 |
| SMILES | C(=O)(C(=O)NNC(=S)N)NNC(=S)N |
| InChIKey | LAMLHZXTNBPGDN-UHFFFAOYSA-N |
Chemical Property Profile of 1,1'-Oxalylbis-3-thiosemicarbazide
Property Insights of 1,1'-Oxalylbis-3-thiosemicarbazide
The XLogP value of -0.6 indicates that 1,1'-Oxalylbis-3-thiosemicarbazide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 198.0 Ų indicates high polarity, suggesting 1,1'-Oxalylbis-3-thiosemicarbazide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,1'-Oxalylbis-3-thiosemicarbazide has 6 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,1'-Oxalylbis-3-thiosemicarbazide?
The CAS number of 1,1'-Oxalylbis-3-thiosemicarbazide is 116974-17-5.
What is the molecular formula of 1,1'-Oxalylbis-3-thiosemicarbazide?
The molecular formula of 1,1'-Oxalylbis-3-thiosemicarbazide is C4H8N6O2S2.
What is the molecular weight of 1,1'-Oxalylbis-3-thiosemicarbazide?
The molecular weight of 1,1'-Oxalylbis-3-thiosemicarbazide is 236.01501 g/mol.
Where can I buy 1,1'-Oxalylbis-3-thiosemicarbazide?
You can request a quote for 1,1'-Oxalylbis-3-thiosemicarbazide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1'-Oxalylbis-3-thiosemicarbazide?
Yes, CoreyChem provides custom synthesis services for 1,1'-Oxalylbis-3-thiosemicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.