Apilimod

C₂₃H₂₆N₆O₂CAS 541550-19-0418.50 g/mol

Open in Covalent MOL file

Ether Hydrazone Secondary amine Tertiary amine

Properties

Molecular formula: C₂₃H₂₆N₆O₂
Molar mass: 418.50 g/mol
Exact mass: 418.2117 Da
logP: 3.08Crippen estimate
Polar surface area: 84.8 Å²
H-bond donors / acceptors: 1 / 8
Rotatable bonds: 8

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

541550-19-0

SMILES

Cc1cccc(C=NNc2cc(N3CCOCC3)nc(OCCc3ccccn3)n2)c1

InChIKey

HSKAZIJJKRAJAV-UHFFFAOYSA-N

InChI

InChI=1S/C23H26N6O2/c1-18-5-4-6-19(15-18)17-25-28-21-16-22(29-10-13-30-14-11-29)27-23(26-21)31-12-8-20-7-2-3-9-24-20/h2-7,9,15-17H,8,10-14H2,1H3,(H,26,27,28)

Weigh it out

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

Names and synonyms

3 names

Benzaldehyde, 3-methyl-, 2-[6-(4-morpholinyl)-2-[2-(2-pyridinyl)ethoxy]-4-pyrimidinyl]hydrazone
Benzaldehyde, 3-methyl-, [6-(4-morpholinyl)-2-[2-(2-pyridinyl)ethoxy]-4-pyrimidinyl]hydrazone
STA 5326

Work with Apilimod

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Apilimod (mesylate)870087-36-8Salt, defined stereoisomer

Similar compounds

Tgx-221663619-89-432 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook