N,N-dimethyl-2-{[1-(quinolin-6-ylmethyl)-1H-[1,2,3]triazolo[4,5-b]pyrazin-6-yl]oxy}ethanamine

HCID 59341930
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Basic information

Standard SMILES
CN(C)CCOc1cnc2nnn(Cc3ccc4ncccc4c3)c2n1
InChIKey
XCECIQOQNJBRNC-UHFFFAOYSA-N
Molecular formula
C18H19N7O
Average molar mass
349.4 g/mol

Names & identifiers

Preferred name
N,N-dimethyl-2-{[1-(quinolin-6-ylmethyl)-1H-[1,2,3]triazolo[4,5-b]pyrazin-6-yl]oxy}ethanamine
IUPAC
N,N-dimethyl-2-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]oxyethanamine

Names & synonyms

CHEMBL2170809SCHEMBL2573976XCECIQOQNJBRNC-UHFFFAOYSA-NBDBM50396964N,N-dimethyl-2-{[1-(quinolin-6-ylmethyl)-1H-[1,2,3]triazolo[4,5-b]pyrazin-6-yl]oxy}ethanamine

Database identifiers

PubChem CID
59341930
ChEMBL
CHEMBL2170809

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
81.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
26

Related reactions

2 records
New reaction record

Linked notes

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