5-(Ethylamino)-1,3,4-thiadiazole-2-thiol
TL;DR: 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol (CAS 55774-34-0) is a chemical compound with molecular formula C4H7N3S2 and molecular weight 161.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(ethylamino)-3H-1,3,4-thiadiazole-2-thione
Also Known As: 5-(ethylamino)-1,3,4-thiadiazole-2-thiol, 5-(ethylamino)-3H-1,3,4-thiadiazole-2-thione, 5-(Ethylamino)-1,3,4-thiadiazole-2(3H)-thione, 2-Ethylamino-5-mercapto-1,3,4-thiadiazol, 5-ethylamino-2-mercapto-1,3,4-thiadiazole
| Molecular Formula | C4H7N3S2 |
|---|---|
| Molecular Weight | 161.01 g/mol |
| LogP | 1.63249 |
| Topological Polar Surface Area | 40.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 161.00813 |
| Heavy Atoms | 9 |
| Complexity | 225.71666 |
Chemical Identifiers
| CAS Number | 55774-34-0 |
|---|---|
| SMILES | CCNC1=NNC(=S)S1 |
Product Overview
5-(Ethylamino)-1,3,4-thiadiazole-2-thiol (CAS 55774-34-0), with molecular formula C4H7N3S2 and molecular weight 161.01 g/mol. IUPAC: 5-(ethylamino)-3H-1,3,4-thiadiazole-2-thione.
Chemical Property Profile of 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol
Property Insights of 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol
The XLogP value of 1.63249 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol. With a topological polar surface area (TPSA) of 40.71 Ų, 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol has 2 hydrogen bond donor(s) and 4 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 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol?
The CAS number of 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol is 55774-34-0.
What is the molecular formula of 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol?
The molecular formula of 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol is C4H7N3S2.
What is the molecular weight of 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol?
The molecular weight of 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol is 161.01 g/mol.
Where can I buy 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol?
You can request a quote for 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 5-(Ethylamino)-1,3,4-thiadiazole-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.