4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol
TL;DR: 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol (CAS 896841-69-3) is a chemical compound with molecular formula C16H12N4O and molecular weight 276.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-methyl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol
Also Known As: 4-(3-methyl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol, 4-(3-methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol, 4-(3-Methyl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)-phenol, 4-(3-methyl-5H-[1,2,4]triazolo[3,4-a]phthalazin-6-ylidene)cyclohexa-2,5-dien-1-one
| Molecular Formula | C16H12N4O |
|---|---|
| Molecular Weight | 276.10 g/mol |
| LogP | 2.95852 |
| Topological Polar Surface Area | 63.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 276.1011 |
| Heavy Atoms | 21 |
| Complexity | 957.26086 |
Chemical Identifiers
| CAS Number | 896841-69-3 |
|---|---|
| SMILES | CC1=NN=C2N1N=C(C3=CC=CC=C32)C4=CC=C(C=C4)O |
Product Overview
4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol (CAS 896841-69-3), with molecular formula C16H12N4O and molecular weight 276.10 g/mol. IUPAC: 4-(3-methyl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol.
Chemical Property Profile of 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol
Property Insights of 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol
The XLogP value of 2.95852 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol. The TPSA of 63.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol. Following Lipinski's Rule of Five, 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol 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-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol?
The CAS number of 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol is 896841-69-3.
What is the molecular formula of 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol?
The molecular formula of 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol is C16H12N4O.
What is the molecular weight of 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol?
The molecular weight of 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol is 276.10 g/mol.
Where can I buy 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol?
You can request a quote for 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-Methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.