chempirical

3-Bromo-N-propylimidazo[1,2-B]pyridazin-6-amine

C9H11BrN4CAS 1034621-79-8255.12 g/mol

Open in Covalent MOL file
HNNNNBr
Aryl halideSecondary amine

Properties

Molecular formula
C9H11BrN4
Molar mass
255.12 g/mol
Exact mass
254.0167 Da
logP
2.31Crippen estimate
Polar surface area
42.2 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
3

Identifiers

CAS number
1034621-79-8
SMILES
CCCNC1=NN2C(=NC=C2Br)C=C1
InChIKey
XRJVIXDRSFFXEX-UHFFFAOYSA-N
InChI
InChI=1S/C9H11BrN4/c1-2-5-11-8-3-4-9-12-6-7(10)14(9)13-8/h3-4,6H,2,5H2,1H3,(H,11,13)

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Type any one amount. The others follow from the molar mass.

Work with 3-Bromo-N-propylimidazo[1,2-B]pyridazin-6-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

3-Bromoimidazo[1,2-B]pyridazine18087-73-538 % similar Propylaniline622-80-032 % similar

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

Elsewhere

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