[4-[6-Amino-5-(1-isopropyltriazol-4-yl)-3-pyridyl]phenyl]-morpholino-methanone

HCID 77106563
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Basic information

Standard SMILES
CC(C)n1cc(-c2cc(-c3ccc(C(=O)N4CCOCC4)cc3)cnc2N)nn1
InChIKey
JSPYSTIFXJPFMV-UHFFFAOYSA-N
Molecular formula
C21H24N6O2
Average molar mass
392.5 g/mol

Names & identifiers

Preferred name
[4-[6-Amino-5-(1-isopropyltriazol-4-yl)-3-pyridyl]phenyl]-morpholino-methanone
IUPAC
[4-[6-amino-5-(1-propan-2-yltriazol-4-yl)-3-pyridinyl]phenyl]-morpholin-4-ylmethanone

Names & synonyms

CHEMBL3938306SCHEMBL15870206JSPYSTIFXJPFMV-UHFFFAOYSA-NBDBM223568DB-130979US9321748, 28[4-[6-Amino-5-(1-isopropyltriazol-4-yl)-3-pyridyl]phenyl]-morpholino-methanone(4-(6-Amino-5-(1-isopropyl-1H-1,2,3-triazol-4-yl)pyridin-3-yl)phenyl)(morpholino)methanone1617499-04-3

Database identifiers

PubChem CID
77106563
ChEMBL
CHEMBL3938306

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
99.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
29

Related reactions

2 records
New reaction record

Compound notes

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