gamma-Secretase modulator 6

HCID 49819500

Basic information

Standard SMILES
COc1nc(Nc2ccc3c(n2)O[C@H](c2ccccc2)CN(C)C3)ccc1-c1cnn(C)c1
InChIKey
IKUXSEKKQNIOCQ-NRFANRHFSA-N
Molecular formula
C25H26N6O2
Average molar mass
442.5 g/mol

Names & identifiers

Preferred name
gamma-Secretase modulator 6
IUPAC
(2R)-N-[6-methoxy-5-(1-methylpyrazol-4-yl)-2-pyridinyl]-4-methyl-2-phenyl-3,5-dihydro-2H-pyrido[3,2-f][1,4]oxazepin-8-amine

Names & synonyms

gamma-secretase modulator 61255700-88-9(R)-N-(6-Methoxy-5-(1-methyl-1H-pyrazol-4-yl)pyridin-2-yl)-4-methyl-2-phenyl-2,3,4,5-tetrahydropyrido[3,2-f][1,4]oxazepin-8-amineorb3029016SCHEMBL3706764IKUXSEKKQNIOCQ-NRFANRHFSA-NHY-171347T206107

Database identifiers

PubChem CID
49819500

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
77.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
33

Related reactions

12 records

Linked notes

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