2-[4-(5-Pyridin-4-yl-[1,2,4]triazol-1-yl)-phenoxymethyl]-quinoline

HCID 11660880
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Basic information

Standard SMILES
c1ccc2nc(COc3ccc(-n4ncnc4-c4ccncc4)cc3)ccc2c1
InChIKey
HMRVDKWASFSAKY-UHFFFAOYSA-N
Molecular formula
C23H17N5O
Average molar mass
379.4 g/mol

Names & identifiers

Preferred name
2-[4-(5-Pyridin-4-yl-[1,2,4]triazol-1-yl)-phenoxymethyl]-quinoline
IUPAC
2-[[4-(5-pyridin-4-yl-1,2,4-triazol-1-yl)phenoxy]methyl]quinoline

Names & synonyms

SCHEMBL3270389SCHEMBL30123632HMRVDKWASFSAKY-UHFFFAOYSA-N2-[4-(5-Pyridin-4-yl-[1,2,4]triazol-1-yl)-phenoxymethyl]-quinoline2-[4-(5-Pyridin4-yl-[1,2,4]triazol-1-yl)-phenoxymethyl]-quinoline

Database identifiers

PubChem CID
11660880

Properties

Computed structural properties

XLogP
4
Topological polar surface area
65.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
29

Related reactions

9 records
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Linked notes

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