2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol
TL;DR: 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol (CAS 900896-33-5) is a chemical compound with molecular formula C19H18N4OS and molecular weight 350.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[6-(4-methylphenyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl]methylsulfanyl]ethanol
Also Known As: 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol, 2-({[6-(4-methylphenyl)[1,2,4]triazolo[3,4-a]phthalazin-3-yl]methyl}sulfanyl)ethanol, 2-[[6-(4-methylphenyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl]methylsulfanyl]ethanol
| Molecular Formula | C19H18N4OS |
|---|---|
| Molecular Weight | 350.12 g/mol |
| LogP | 3.47842 |
| Topological Polar Surface Area | 63.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.12012 |
| Heavy Atoms | 25 |
| Complexity | 1026.8965 |
Chemical Identifiers
| CAS Number | 900896-33-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN3C(=NN=C3C4=CC=CC=C42)CSCCO |
Product Overview
2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol (CAS 900896-33-5), with molecular formula C19H18N4OS and molecular weight 350.12 g/mol. IUPAC: 2-[[6-(4-methylphenyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl]methylsulfanyl]ethanol.
Chemical Property Profile of 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol
Property Insights of 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol
The XLogP value of 3.47842 indicates that 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol. Following Lipinski's Rule of Five, 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol has 1 hydrogen bond donor(s) and 5 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 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol?
The CAS number of 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol is 900896-33-5.
What is the molecular formula of 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol?
The molecular formula of 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol is C19H18N4OS.
What is the molecular weight of 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol?
The molecular weight of 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol is 350.12 g/mol.
Where can I buy 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol?
You can request a quote for 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(((6-(p-tolyl)-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl)thio)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.