Pyrrolo[2,1-F][1,2,4]triazin-4(1H)-one

C₆H₅N₃OCAS 159326-71-3135.13 g/mol

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Properties

Molecular formula: C₆H₅N₃O
Molar mass: 135.13 g/mol
Exact mass: 135.0433 Da
logP: 0.02Crippen estimate
Polar surface area: 50.2 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Identifiers

CAS number

159326-71-3

SMILES

O=c1nc[nH]n2cccc12

InChIKey

VYEHSYWBLDTUHX-UHFFFAOYSA-N

InChI

InChI=1S/C6H5N3O/c10-6-5-2-1-3-9(5)8-4-7-6/h1-4H,(H,7,8,10)

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Names and synonyms

2 names

Pyrrolo[2,1-f]-[1,2,4]triazin-4-ol
1H,4H-Pyrrolo[2,1-f][1,2,4]triazin-4-one

Work with Pyrrolo[2,1-F][1,2,4]triazin-4(1H)-one

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

Furo[2,3-D]pyrimidin-4-amine186454-70-6 Hydroxybenzotriazole2592-95-2 4-Hydroxybenzotriazole26725-51-9 7-Deazahypoxanthine3680-71-5 1,2,4-Triazolo[4,3-A]pyridin-3(2H)-one6969-71-7 2,1,3-Benzoxadiazol-4-amine767-63-5

Elsewhere

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