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

HCID 59341800

Basic information

Standard SMILES
OC1CCN(c2cnc3nnn(Cc4ccc5ncccc5c4)c3n2)C1
InChIKey
DSXKHNQVXUJTRO-UHFFFAOYSA-N
Molecular formula
C18H17N7O
Average molar mass
347.4 g/mol

Names & identifiers

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

Names & synonyms

CHEMBL2170807SCHEMBL2571830DSXKHNQVXUJTRO-UHFFFAOYSA-NBDBM50396966DB-3748321-[1-(6-Quinolinylmethyl)-1H-1,2,3-triazolo[4,5-b]pyrazin-6-yl]-3-pyrrolidinol1-[1-(quinolin-6-ylmethyl)-1H-[1,2,3]triazolo[4,5-b]pyrazin-6-yl]pyrrolidin-3-ol956905-49-0

Database identifiers

PubChem CID
59341800
ChEMBL
CHEMBL2170807

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
92.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
26

Related reactions

4 records

Linked notes

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