![4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione structure](/static/products/1325/132573-88-7.webp)
4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione
TL;DR: 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione (CAS 132573-88-7) is a chemical compound with molecular formula C11H14N4OS and molecular weight 250.08884 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione
Also Known As: BAS 00385891, BIM-0029106.P001, AB00094803-01, 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione, 4-Amino-5-(4-ethoxy-benzyl)-4H-[1,2,4]triazole-3-thiol
Technical Specifications
| Molecular Formula | C11H14N4OS |
| Molecular Weight | 250.08884 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 95.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 250.08884 Da |
| Heavy Atoms | 17 |
| Complexity | 313.0 |
| SMILES | CCOC1=CC=C(C=C1)CC2=NNC(=S)N2N |
| InChIKey | GAZVCXWBDFGXGD-UHFFFAOYSA-N |
Chemical Property Profile of 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione
Property Insights of 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione. The TPSA of 95.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione. Following Lipinski's Rule of Five, 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-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
What is the CAS number of 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione?
The CAS number of 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione is 132573-88-7.
What is the molecular formula of 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione?
The molecular formula of 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione is C11H14N4OS.
What is the molecular weight of 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione?
The molecular weight of 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione is 250.08884 g/mol.
Where can I buy 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione?
You can request a quote for 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione?
Yes, CoreyChem provides custom synthesis services for 4-amino-3-[(4-ethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.