![1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]- structure](/static/products/536/536719-67-2.png)
1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]-
TL;DR: 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]- (CAS 536719-67-2) is a chemical compound with molecular formula C13H11N3S and molecular weight 241.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(naphthalen-2-ylmethylsulfanyl)-1H-1,2,4-triazole
Also Known As: 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]-, J1.906.161B, 3-[(2-naphthylmethyl)thio]-1H-1,2,4-triazole, 1H-1,2,4-Triazole,3-[(2-naphthalenylmethyl)thio], 3-((2-naphthylmethyl)sulfanyl)-4h-1,2,4-triazole
| Molecular Formula | C13H11N3S |
|---|---|
| Molecular Weight | 241.07 g/mol |
| LogP | 3.2502 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.06737 |
| Heavy Atoms | 17 |
| Complexity | 619.4057 |
Chemical Identifiers
| CAS Number | 536719-67-2 |
|---|---|
| SMILES | C1=CC=C2C=C(C=CC2=C1)CSC3=NC=NN3 |
Product Overview
1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]- (CAS 536719-67-2), with molecular formula C13H11N3S and molecular weight 241.07 g/mol. IUPAC: 5-(naphthalen-2-ylmethylsulfanyl)-1H-1,2,4-triazole.
Chemical Property Profile of 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]-
Property Insights of 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]-
The XLogP value of 3.2502 indicates that 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.57 Ų, 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]- has 1 hydrogen bond donor(s) and 3 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 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]-?
The CAS number of 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]- is 536719-67-2.
What is the molecular formula of 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]-?
The molecular formula of 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]- is C13H11N3S.
What is the molecular weight of 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]-?
The molecular weight of 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]- is 241.07 g/mol.
Where can I buy 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]-?
You can request a quote for 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]-?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,2,4-Triazole, 3-[(2-naphthalenylmethyl)thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.