chempirical

Lenvatinib mesylate

C22H23ClN4O7SCAS 857890-39-2522.96 g/mol

Open in Covalent MOL file
ONONHOHNClH2NOSOOOH
Aryl halideEtherSulfonic acid

Properties

Molecular formula
C22H23ClN4O7S
Molar mass
522.96 g/mol
Exact mass
522.0976 Da
logP
4.56Crippen estimate
Polar surface area
174.4 Ų
H-bond donors / acceptors
5 / 7
Rotatable bonds
6

Identifiers

CAS number
857890-39-2
SMILES
COc1cc2nccc(Oc3ccc(NC(O)=NC4CC4)c(Cl)c3)c2cc1C(=N)O.CS(=O)(=O)O
InChIKey
HWLFIUUAYLEFCT-UHFFFAOYSA-N
InChI
InChI=1S/C21H19ClN4O4.CH4O3S/c1-29-19-10-17-13(9-14(19)20(23)27)18(6-7-24-17)30-12-4-5-16(15(22)8-12)26-21(28)25-11-2-3-11;1-5(2,3)4/h4-11H,2-3H2,1H3,(H2,23,27)(H2,25,26,28);1H3,(H,2,3,4)

Weigh it out

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

Names and synonyms

7 names
  • 6-Quinolinecarboxamide, 4-[3-chloro-4-[[(cyclopropylamino)carbonyl]amino]phenoxy]-7-methoxy-, methanesulfonate (1:1)
  • 6-Quinolinecarboxamide, 4-[3-chloro-4-[[(cyclopropylamino)carbonyl]amino]phenoxy]-7-methoxy-, monomethanesulfonate
  • E 7080 Mesylate
  • Lenvatinib methanesulfonate
  • 4-[3-Chloro-4-[(cyclopropylaminocarbonyl)amino]phenoxy]-7-methoxy-6-quinolinecarboxamide mesylate
  • Kisplyx
  • Lenvima

Work with Lenvatinib mesylate

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

Lenvatinib417716-92-888 % similar Tivozanib475108-18-039 % similar Cabozantinib849217-68-133 % similar 4-[(6,7-Dimethoxyquinolin-4-yl)oxy]aniline190728-25-733 % similar Cabozantinib S-malate1140909-48-332 % similar Glibenclamide10238-21-830 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook