4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol
TL;DR: 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol (CAS 847783-74-8) is a chemical compound with molecular formula C8H14N4OS and molecular weight 214.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethyl-3-morpholin-4-yl-1H-1,2,4-triazole-5-thione
Also Known As: 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol, 4-Ethyl-5-morpholino-4H-1,2,4-triazole-3-thiol, 4-ethyl-3-morpholin-4-yl-1H-1,2,4-triazole-5-thione, 4-ethyl-5-(morpholin-4-yl)-4H-1,2,4-triazole-3-thiol, AB00734430-01
| Molecular Formula | C8H14N4OS |
|---|---|
| Molecular Weight | 214.09 g/mol |
| LogP | 0.79719 |
| Topological Polar Surface Area | 46.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.08884 |
| Heavy Atoms | 14 |
| Complexity | 352.4684 |
Chemical Identifiers
| CAS Number | 847783-74-8 |
|---|---|
| SMILES | CCN1C(=S)NN=C1N2CCOCC2 |
Product Overview
4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol (CAS 847783-74-8), with molecular formula C8H14N4OS and molecular weight 214.09 g/mol. IUPAC: 4-ethyl-3-morpholin-4-yl-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol
Property Insights of 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol
The XLogP value of 0.79719 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol. With a topological polar surface area (TPSA) of 46.08 Ų, 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol has 1 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 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol?
The CAS number of 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol is 847783-74-8.
What is the molecular formula of 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol?
The molecular formula of 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol is C8H14N4OS.
What is the molecular weight of 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol?
The molecular weight of 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol is 214.09 g/mol.
Where can I buy 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol?
You can request a quote for 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol?
Yes, KEHONG BIO provides custom synthesis services for 4-ethyl-5-morpholin-4-yl-4H-1,2,4-triazole-3-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.