4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
TL;DR: 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione (CAS 851879-31-7) is a chemical compound with molecular formula C10H12N4OS and molecular weight 236.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-3-(2-ethoxyphenyl)-1H-1,2,4-triazole-5-thione
Also Known As: 4-amino-5-(2-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol, 4-amino-3-(2-ethoxyphenyl)-1H-1,2,4-triazole-5-thione, J2.517.801G, 4-amino-3-(2-ethoxyphenyl)-4,5-dihydro-1H-1,2,4-triazole-5-thione, 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
| Molecular Formula | C10H12N4OS |
|---|---|
| Molecular Weight | 236.07 g/mol |
| LogP | 1.72019 |
| Topological Polar Surface Area | 68.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.07318 |
| Heavy Atoms | 16 |
| Complexity | 545.7472 |
Chemical Identifiers
| CAS Number | 851879-31-7 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C2=NNC(=S)N2N |
Product Overview
4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione (CAS 851879-31-7), with molecular formula C10H12N4OS and molecular weight 236.07 g/mol. IUPAC: 4-amino-3-(2-ethoxyphenyl)-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Property Insights of 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
The XLogP value of 1.72019 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione. The TPSA of 68.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione. Following Lipinski's Rule of Five, 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione 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 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The CAS number of 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is 851879-31-7.
What is the molecular formula of 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The molecular formula of 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is C10H12N4OS.
What is the molecular weight of 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The molecular weight of 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is 236.07 g/mol.
Where can I buy 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
You can request a quote for 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.