2-(4-Methoxyphenyl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one - CAS 135104-21-1
Catalog: |
BB047391 |
Product Name: |
2-(4-Methoxyphenyl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one |
CAS: |
135104-21-1 |
Synonyms: |
2-(4-methoxyphenyl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one |
IUPAC Name: | 2-(4-methoxyphenyl)-5H-pyrazolo[1,5-d][1,2,4]triazin-4-one |
Description: | 2-(4-Methoxyphenyl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one (CAS# 135104-21-1 ) is a useful research chemical. |
Molecular Weight: | 242.23 |
Molecular Formula: | C12H10N4O2 |
Canonical SMILES: | COC1=CC=C(C=C1)C2=NN3C=NNC(=O)C3=C2 |
InChI: | InChI=1S/C12H10N4O2/c1-18-9-4-2-8(3-5-9)10-6-11-12(17)14-13-7-16(11)15-10/h2-7H,1H3,(H,14,17) |
InChI Key: | FXMJSCUFNDTUHH-UHFFFAOYSA-N |
Purity: | 97 % |
Density: | 1.4±0.1 g/cm3 |
Complexity: | 352 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 242.08037557 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 242.08037557 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 68.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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