7-Iodopyrrolo[2,1-f][1,2,4]triazin-4-amine

C₆H₅IN₄CAS 1770840-43-1260.04 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₆H₅IN₄
Molar mass: 260.04 g/mol
Exact mass: 259.9559 Da
logP: 0.92Crippen estimate
Polar surface area: 56.2 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

1770840-43-1

SMILES

C1=C2C(=NC=NN2C(=C1)I)N

InChIKey

ZEBGLCLVPCOXIV-UHFFFAOYSA-N

InChI

InChI=1S/C6H5IN4/c7-5-2-1-4-6(8)9-3-10-11(4)5/h1-3H,(H2,8,9,10)

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Names and synonyms

1 names

4-Amino-7-iodopyrrolo[2,1-F][1,2,4]triazine

Work with 7-Iodopyrrolo[2,1-f][1,2,4]triazin-4-amine

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

Similar compounds

7-Bromopyrrolo[2,1-f][1,2,4]triazin-4-amine937046-98-559 % similar Pyrrolo[2,1-f][1,2,4]triazin-4-amine159326-68-844 % similar 4-Amino-7-bromoimidazo[2,1-F][1,2,4]triazine1235374-44-338 % similar Gs-4415241191237-69-034 % similar 4-Amino-1-phenylpyrazolo(3,4-d)pyrimidine5334-30-532 % similar Remdesivir N-21191237-80-532 % similar Remdesivir impurity21355357-49-131 % similar (3-Chloro-4-iodopyridin-2-yl)amine1152617-24-731 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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