Capmatinib

C₂₃H₁₇FN₆OCAS 1029712-80-8412.43 g/mol

Open in Covalent MOL file

Aryl halide

Properties

Molecular formula: C₂₃H₁₇FN₆O
Molar mass: 412.43 g/mol
Exact mass: 412.1448 Da
logP: 4.00Crippen estimate
Polar surface area: 88.6 Å²
H-bond donors / acceptors: 1 / 5
Rotatable bonds: 4

Hazards

Danger

H301 Toxic if swallowed100% of notifiers
H360 May damage fertility or the unborn child25% of notifiers
H360D May damage the unborn child75% of notifiers
H373 May causes damage to organs through prolonged or repeated exposure100% of notifiers
H411 Toxic to aquatic life with long lasting effects100% of notifiers

Aggregated from 8 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P260, P264, P270, P273, P280, P301+P316, P318, P319, P321, P330, P391, P405, P501

Identifiers

CAS number

1029712-80-8

SMILES

CN=C(O)c1ccc(-c2cnc3ncc(Cc4ccc5ncccc5c4)n3n2)cc1F

InChIKey

LIOLIMKSCNQPLV-UHFFFAOYSA-N

InChI

InChI=1S/C23H17FN6O/c1-25-22(31)18-6-5-16(11-19(18)24)21-13-28-23-27-12-17(30(23)29-21)10-14-4-7-20-15(9-14)3-2-8-26-20/h2-9,11-13H,10H2,1H3,(H,25,31)

Weigh it out

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

Names and synonyms

7 names

Benzamide, 2-fluoro-N-methyl-4-[7-(6-quinolinylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]-
2-Fluoro-N-methyl-4-[7-(6-quinolinylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzamide
2-Fluoro-N-methyl-4-[7-[(quinolin-6-yl)methyl]imidazo[1,2-b]-[1,2,4]triazin-2-yl]benzamide
INCB 28060
INC 280
NVP-INC 280NX
Tabrecta

Work with Capmatinib

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

6-Quinolinemethanol100516-88-933 % similar 6-Aminomethylquinoline99071-54-231 % similar Methyl 6-quinolineacetate5622-36-631 % similar 4-[(1-Cyanocyclobutyl)amino]-2-fluoro-N-methylbenzamide915087-26-230 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook