2-Mercapto-5-Methyl-1,3,4-Thiadiazole
TL;DR: 2-Mercapto-5-Methyl-1,3,4-Thiadiazole (CAS 36988-21-3) is a chemical compound with molecular formula C3H4N2S2 and molecular weight 131.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3H-1,3,4-thiadiazole-2-thione
Also Known As: 5-Methyl-1,3,4-thiadiazole-2-thiol, 2-Mercapto-5-methyl-1,3,4-thiadiazole, Cefazolin Impurity E, Cefazolin EP Impurity E, 5-Methyl-1,3,4-thiadiazole-2(3H)-thione
| Molecular Formula | C3H4N2S2 |
|---|---|
| Molecular Weight | 131.98 g/mol |
| LogP | 1.50911 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 131.9816 |
| Heavy Atoms | 7 |
| Complexity | 198.69986 |
Chemical Identifiers
| CAS Number | 36988-21-3 |
|---|---|
| SMILES | CC1=NNC(=S)S1 |
Product Overview
2-Mercapto-5-Methyl-1,3,4-Thiadiazole (CAS 36988-21-3), with molecular formula C3H4N2S2 and molecular weight 131.98 g/mol. IUPAC: 5-methyl-3H-1,3,4-thiadiazole-2-thione.
Chemical Property Profile of 2-Mercapto-5-Methyl-1,3,4-Thiadiazole
Property Insights of 2-Mercapto-5-Methyl-1,3,4-Thiadiazole
The XLogP value of 1.50911 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Mercapto-5-Methyl-1,3,4-Thiadiazole. With a topological polar surface area (TPSA) of 28.68 Ų, 2-Mercapto-5-Methyl-1,3,4-Thiadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Mercapto-5-Methyl-1,3,4-Thiadiazole 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
Frequently Asked Questions
What is the CAS number of 2-Mercapto-5-Methyl-1,3,4-Thiadiazole?
The CAS number of 2-Mercapto-5-Methyl-1,3,4-Thiadiazole is 36988-21-3.
What is the molecular formula of 2-Mercapto-5-Methyl-1,3,4-Thiadiazole?
The molecular formula of 2-Mercapto-5-Methyl-1,3,4-Thiadiazole is C3H4N2S2.
What is the molecular weight of 2-Mercapto-5-Methyl-1,3,4-Thiadiazole?
The molecular weight of 2-Mercapto-5-Methyl-1,3,4-Thiadiazole is 131.98 g/mol.
Where can I buy 2-Mercapto-5-Methyl-1,3,4-Thiadiazole?
You can request a quote for 2-Mercapto-5-Methyl-1,3,4-Thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Mercapto-5-Methyl-1,3,4-Thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Mercapto-5-Methyl-1,3,4-Thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.