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6-Benzyloxy-4-(4-fluoroindol-5-yloxy)-7-methoxyquinazoline

HCID 58960230
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1cc2ncnc(Oc3ccc4[nH]ccc4c3F)c2cc1OCc1ccccc1
InChIKey
GQFYMKKLRUQLPM-UHFFFAOYSA-N
Molecular formula
C24H18FN3O3
Average molar mass
415.4 g/mol

Names & identifiers

Preferred name
6-Benzyloxy-4-(4-fluoroindol-5-yloxy)-7-methoxyquinazoline
IUPAC
4-[(4-fluoro-1H-indol-5-yl)oxy]-7-methoxy-6-phenylmethoxyquinazoline

Names & synonyms

SCHEMBL1401701GQFYMKKLRUQLPM-UHFFFAOYSA-N6-benzyloxy-4-(4-fluoroindol-5-yloxy)-7-methoxyquinazoline

Database identifiers

PubChem CID
58960230

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
69.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
31
Formal charge
0
Complexity
578

Related reactions

6 records
New reaction record
HRID 916412 reaction equation
HRID 916412As productuspto-grants-2007_09
HRID 916413 reaction equation
HRID 916413As reactantuspto-grants-2007_09
HRID 1550594 reaction equation
HRID 1550594As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1551362 reaction equation
HRID 1551362As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 2068056 reaction equation
HRID 2068056As productuspto-grants-2012_10
HRID 2068057 reaction equation
HRID 2068057As reactantuspto-grants-2012_10

Compound notes

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