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234-80-0 | 1,2,4-Triazolo[3,4-a]phthalazine
CAS No: 234-80-0 Catalog No: AG002N3Y MDL No:
Product Description
Catalog Number:
AG002N3Y
Chemical Name:
1,2,4-Triazolo[3,4-a]phthalazine
CAS Number:
234-80-0
Molecular Formula:
C9H6N4
Molecular Weight:
170.1707
IUPAC Name:
[1,2,4]triazolo[3,4-a]phthalazine
InChI:
InChI=1S/C9H6N4/c1-2-4-8-7(3-1)5-11-13-6-10-12-9(8)13/h1-6H
InChI Key:
JVJPJKLSGUJUJK-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)c1nncn1nc2
NSC Number:
116341
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.175g/mol
Monoisotopic Mass:
170.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| Identification and synthesis of [1,2,4]triazolo[3,4-a]phthalazine derivatives as high-affinity ligands to the alpha 2 delta-1 subunit of voltage gated calcium channel. | Bioorganic & medicinal chemistry letters 20040517 |
| A novel methylthio metabolite of s-triazolo[3,4-a]phthalazine, a lead compound for the development of antianxiety drugs, in rats. | Life sciences 20031121 |
| A new fluorimetric method for the determination of formaldehyde in air based on the liquid droplet sampling technique. | The Analyst 20010101 |
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