3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile
TL;DR: 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile (CAS 132432-21-4) is a chemical compound with molecular formula C6H7N3S2 and molecular weight 185.00813 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanenitrile
Also Known As: 3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanenitrile, 3-(5-methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile, 3-((5-methyl-1,3,4-thiadiazol-2-yl)thio)propanenitrile
Technical Specifications
| Molecular Formula | C6H7N3S2 |
| Molecular Weight | 185.00813 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 185.00813 Da |
| Heavy Atoms | 11 |
| Complexity | 164.0 |
| SMILES | CC1=NN=C(S1)SCCC#N |
| InChIKey | VVSDGLYQFPFFJB-UHFFFAOYSA-N |
Chemical Property Profile of 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile
Property Insights of 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile. Following Lipinski's Rule of Five, 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile has 0 hydrogen bond donor(s) and 5 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-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile?
The CAS number of 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile is 132432-21-4.
What is the molecular formula of 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile?
The molecular formula of 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile is C6H7N3S2.
What is the molecular weight of 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile?
The molecular weight of 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile is 185.00813 g/mol.
Where can I buy 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile?
You can request a quote for 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile?
Yes, CoreyChem provides custom synthesis services for 3-(5-Methyl-1,3,4-thiadiazol-2-ylthio)propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.