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2-(2,6-dimethylpyridin-4-yl)-7-fluoro-5-(2-phenoxyethoxy)-3H-quinazolin-4-one

HCID 136348019
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1cc(-c2nc3cc(F)cc(OCCOc4ccccc4)c3c(=O)[nH]2)cc(C)n1
InChIKey
PHVTXOPWAOQLJG-UHFFFAOYSA-N
Molecular formula
C23H20FN3O3
Average molar mass
405.4 g/mol

Names & identifiers

Preferred name
2-(2,6-dimethylpyridin-4-yl)-7-fluoro-5-(2-phenoxyethoxy)-3H-quinazolin-4-one
IUPAC
2-(2,6-dimethyl-4-pyridinyl)-7-fluoro-5-(2-phenoxyethoxy)-3H-quinazolin-4-one

Names & synonyms

SCHEMBL377893PHVTXOPWAOQLJG-UHFFFAOYSA-N2-(2,6-dimethylpyridin-4-yl)-7-fluoro-5-(2-phenoxyethoxy)-3H-quinazolin-4-one

Database identifiers

PubChem CID
136348019

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
72.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
30
Formal charge
0
Complexity
615

Related reactions

2 records
New reaction record
HRID 591821 reaction equation
HRID 591821As productuspto-grants-2016_01
HRID 591822 reaction equation
HRID 591822As reactantuspto-grants-2016_01

Compound notes

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