1-[1-(quinolin-6-ylmethyl)-1H-[1,2,3]triazolo[4,5-b]pyrazin-6-yl]pyrrolidin-3-one

HCID 59341815
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Basic information

Standard SMILES
O=C1CCN(c2cnc3nnn(Cc4ccc5ncccc5c4)c3n2)C1
InChIKey
BZPNHKIJWLHLNL-UHFFFAOYSA-N
Molecular formula
C18H15N7O
Average molar mass
345.4 g/mol
Monoisotopic mass
345.13380813

Names & identifiers

Preferred name
1-[1-(quinolin-6-ylmethyl)-1H-[1,2,3]triazolo[4,5-b]pyrazin-6-yl]pyrrolidin-3-one
IUPAC
1-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrrolidin-3-one

Names & synonyms

SCHEMBL2569779BZPNHKIJWLHLNL-UHFFFAOYSA-N1-[1-(quinolin-6-ylmethyl)-1H-[1,2,3]triazolo[4,5-b]pyrazin-6-yl]pyrrolidin-3-one

Database identifiers

PubChem CID
59341815

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
89.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
26

Related reactions

5 records
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Compound notes

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