![4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione structure](/static/products/1005/1005578-74-4.webp)
4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione
TL;DR: 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione (CAS 1005578-74-4) is a chemical compound with molecular formula C14H14FN5OS and molecular weight 319.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione
Also Known As: 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione, 4-(1,3-dimethyl-1H-pyrazol-4-yl)-5-[(4-fluorophenoxy)methyl]-4H-1,2,4-triazole-3-thiol, 4-(1,3-dimethylpyrazol-4-yl)-5-[(4-fluorophenoxy)methyl]-1,2,4-triazole-3-thio l, 4-(1,3-dimethylpyrazol-4-yl)-5-[(4-fluorophenoxy)methyl]-2H-1,2,4-triazole-3-thione, 4-(1,3-DIMETHYL-1H-PYRAZOL-4-YL)-5-[(4-FLUOROPHENOXY)METHYL]-4H-1,2,4-TRIAZOL-3-YLHYDROSULFIDE
| Molecular Formula | C14H14FN5OS |
|---|---|
| Molecular Weight | 319.09 g/mol |
| LogP | 2.68991 |
| Topological Polar Surface Area | 60.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.0903 |
| Heavy Atoms | 22 |
| Complexity | 848.99304 |
Chemical Identifiers
| CAS Number | 1005578-74-4 |
|---|---|
| SMILES | CC1=NN(C=C1N2C(=NNC2=S)COC3=CC=C(C=C3)F)C |
Product Overview
4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione (CAS 1005578-74-4), with molecular formula C14H14FN5OS and molecular weight 319.09 g/mol. IUPAC: 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione
Property Insights of 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione
The XLogP value of 2.68991 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione. The TPSA of 60.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione. Following Lipinski's Rule of Five, 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione 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-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione?
The CAS number of 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione is 1005578-74-4.
What is the molecular formula of 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione?
The molecular formula of 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione is C14H14FN5OS.
What is the molecular weight of 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione?
The molecular weight of 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione is 319.09 g/mol.
Where can I buy 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione?
You can request a quote for 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,3-dimethylpyrazol-4-yl)-3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazole-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.