3-(Bromomethyl)-2-cyclopropyl-4-(4-fluorophenyl)quinoline

C₁₉H₁₅BrFNCAS 154057-56-4356.24 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide

Properties

Molecular formula: C₁₉H₁₅BrFN
Molar mass: 356.24 g/mol
Exact mass: 355.0372 Da
logP: 5.81Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 3

Identifiers

CAS number

154057-56-4

SMILES

Fc1ccc(-c2c(CBr)c(C3CC3)nc3ccccc23)cc1

InChIKey

QCNHMJKMLPPGMF-UHFFFAOYSA-N

InChI

InChI=1S/C19H15BrFN/c20-11-16-18(12-7-9-14(21)10-8-12)15-3-1-2-4-17(15)22-19(16)13-5-6-13/h1-4,7-10,13H,5-6,11H2

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Names and synonyms

1 names

Quinoline, 3-(bromomethyl)-2-cyclopropyl-4-(4-fluorophenyl)-

Work with 3-(Bromomethyl)-2-cyclopropyl-4-(4-fluorophenyl)quinoline

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

[2-Cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]methanol121660-11-574 % similar 2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinecarboxaldehyde121660-37-562 % similar (2E)-3-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-2-propenal148901-68-257 % similar (2E)-3-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-2-propenenitrile256431-72-857 % similar Methyl 2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinecarboxylate121659-86-755 % similar Pitavastatin147511-69-145 % similar Pitavastatin calcium147526-32-742 % similar Ethyl (6E)-7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-5-hydroxy-3-oxo-6-heptenoate148901-69-342 % similar

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

Elsewhere

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