1,3,4-Thiadiazole-2(3H)-thione, 5-propyl-
TL;DR: 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl- (CAS 37663-50-6) is a chemical compound with molecular formula C5H8N2S2 and molecular weight 160.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-propyl-3H-1,3,4-thiadiazole-2-thione
Also Known As: 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl-, 5-propyl-3H-1,3,4-thiadiazole-2-thione, 5-propyl-1,3,4-thiadiazole-2(3h)-thione, 5-PROPYL-[1,3,4]THIADIAZOLE-2-THIOL, 5-propyl-1,3,4-thiadiazole-2-thiol
| Molecular Formula | C5H8N2S2 |
|---|---|
| Molecular Weight | 160.01 g/mol |
| LogP | 2.15319 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 160.0129 |
| Heavy Atoms | 9 |
| Complexity | 224.86191 |
Chemical Identifiers
| CAS Number | 37663-50-6 |
|---|---|
| SMILES | CCCC1=NNC(=S)S1 |
Product Overview
1,3,4-Thiadiazole-2(3H)-thione, 5-propyl- (CAS 37663-50-6), with molecular formula C5H8N2S2 and molecular weight 160.01 g/mol. IUPAC: 5-propyl-3H-1,3,4-thiadiazole-2-thione.
Chemical Property Profile of 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl-
Property Insights of 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl-
The XLogP value of 2.15319 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl-. With a topological polar surface area (TPSA) of 28.68 Ų, 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl- 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 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl-?
The CAS number of 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl- is 37663-50-6.
What is the molecular formula of 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl-?
The molecular formula of 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl- is C5H8N2S2.
What is the molecular weight of 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl-?
The molecular weight of 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl- is 160.01 g/mol.
Where can I buy 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl-?
You can request a quote for 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-Thiadiazole-2(3H)-thione, 5-propyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.