![3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione structure](/static/products/955/955858-22-7.png)
3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione
TL;DR: 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione (CAS 955858-22-7) is a chemical compound with molecular formula C21H14FN5S and molecular weight 387.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione
Also Known As: 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione, 5-(3-(4-fluorophenyl)-1H-pyrazol-5-yl)-4-(naphthalen-1-yl)-4H-1,2,4-triazole-3-thiol, 5-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-(1-naphthyl)-4H-1,2,4-triazole-3-thiol, 5-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-(naphthalen-1-yl)-4H-1,2,4-triazole-3-thiol
| Molecular Formula | C21H14FN5S |
|---|---|
| Molecular Weight | 387.10 g/mol |
| LogP | 5.27929 |
| Topological Polar Surface Area | 62.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 387.0954 |
| Heavy Atoms | 28 |
| Complexity | 1342.014 |
Chemical Identifiers
| CAS Number | 955858-22-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2N3C(=NNC3=S)C4=CC(=NN4)C5=CC=C(C=C5)F |
Product Overview
3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione (CAS 955858-22-7), with molecular formula C21H14FN5S and molecular weight 387.10 g/mol. IUPAC: 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione
Property Insights of 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione
The XLogP value of 5.27929 indicates that 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione. Following Lipinski's Rule of Five, 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione?
The CAS number of 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione is 955858-22-7.
What is the molecular formula of 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione?
The molecular formula of 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione is C21H14FN5S.
What is the molecular weight of 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione?
The molecular weight of 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione is 387.10 g/mol.
Where can I buy 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione?
You can request a quote for 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-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 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.