chempirical

Linsitinib

C26H23N5OCAS 867160-71-2421.50 g/mol

Open in Covalent MOL file
HONNNHNHN
Alcohol

Properties

Molecular formula
C26H23N5O
Molar mass
421.50 g/mol
Exact mass
421.1903 Da
logP
4.65Crippen estimate
Polar surface area
90.1 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
3
Stereocentres
s, sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
867160-71-2
SMILES
C[C@]1(O)C[C@@H](c2nc(-c3ccc4ccc(-c5ccccc5)nc4c3)c3c(=N)[nH]ccn32)C1
InChIKey
PKCDDUHJAFVJJB-VLZXCDOPNA-N
InChI
InChI=1/C26H23N5O/c1-26(32)14-19(15-26)25-30-22(23-24(27)28-11-12-31(23)25)18-8-7-17-9-10-20(29-21(17)13-18)16-5-3-2-4-6-16/h2-13,19,32H,14-15H2,1H3,(H2,27,28)/t19-,26+

Weigh it out

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Names and synonyms

4 names
  • Cyclobutanol, 3-[8-amino-1-(2-phenyl-7-quinolinyl)imidazo[1,5-a]pyrazin-3-yl]-1-methyl-, cis-
  • cis-3-[8-Amino-1-(2-phenyl-7-quinolinyl)imidazo[1,5-a]pyrazin-3-yl]-1-methylcyclobutanol
  • OSI 906
  • OSI 906AA

Work with Linsitinib

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-Phenylquinoline612-96-431 % similar

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

Elsewhere

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