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

C19H15BrFNCAS 154057-56-4356.24 g/mol

Open in Covalent MOL file
FBrN
Alkyl halideAryl 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 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

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)-quinolin-3-ylmethyl]-triphenyl-phosphonium bromido154057-58-664 % 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 (E)-3-(2-Cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl)acrylonitrile256431-72-857 % similar Methyl 2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinecarboxylate121659-86-755 % similar 9-Bromomethylacridine1556-34-945 % similar Pitavastatin lactone141750-63-245 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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