![2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione structure](/static/products/3029/302901-03-7.webp)
2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione
TL;DR: 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione (CAS 302901-03-7) is a chemical compound with molecular formula C21H16F3N3S2 and molecular weight 431.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(naphthalen-1-ylmethylsulfanylmethyl)-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione
Also Known As: 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione, 3-(naphthalen-1-ylmethylsulfanylmethyl)-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione, 5-(naphthalen-1-ylmethylsulfanylmethyl)-4-[3-(trifluoromethyl)phenyl]-2H-1,2,4-triazole-3-thione
| Molecular Formula | C21H16F3N3S2 |
|---|---|
| Molecular Weight | 431.07 g/mol |
| LogP | 6.53529 |
| Topological Polar Surface Area | 33.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.07376 |
| Heavy Atoms | 29 |
| Complexity | 1206.2437 |
Chemical Identifiers
| CAS Number | 302901-03-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2CSCC3=NNC(=S)N3C4=CC=CC(=C4)C(F)(F)F |
Product Overview
2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione (CAS 302901-03-7), with molecular formula C21H16F3N3S2 and molecular weight 431.07 g/mol. IUPAC: 3-(naphthalen-1-ylmethylsulfanylmethyl)-4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione
Property Insights of 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione
The XLogP value of 6.53529 indicates that 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.61 Ų, 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione has 1 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 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione?
The CAS number of 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione is 302901-03-7.
What is the molecular formula of 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione?
The molecular formula of 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione is C21H16F3N3S2.
What is the molecular weight of 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione?
The molecular weight of 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione is 431.07 g/mol.
Where can I buy 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione?
You can request a quote for 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-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 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dihydro-5-[[(1-naphthalenylmethyl)thio]methyl]-4-[3-(trifluoromethyl)phenyl]-3H-1,2,4-triazole-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.