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4-(Pyrazin-2-ylamino)quinazolin-6-ol

HCID 136334744
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Oc1ccc2ncnc(Nc3cnccn3)c2c1
InChIKey
QJGLBLQDDGYTRL-UHFFFAOYSA-N
Molecular formula
C12H9N5O
Average molar mass
239.23 g/mol

Names & identifiers

Preferred name
4-(Pyrazin-2-ylamino)quinazolin-6-ol
IUPAC
4-(pyrazin-2-ylamino)quinazolin-6-ol

Names & synonyms

SCHEMBL2642947QJGLBLQDDGYTRL-UHFFFAOYSA-N4-(pyrazin-2-ylamino)quinazolin-6-ol

Database identifiers

PubChem CID
136334744

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
83.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
18
Formal charge
0
Complexity
277

Related reactions

5 records
New reaction record
HRID 81656 reaction equation
HRID 81656As reactantuspto-grants-2014_09
HRID 81657 reaction equation
HRID 81657As reactantuspto-grants-2014_09
HRID 97534 reaction equation
HRID 97534As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1517295 reaction equation
HRID 1517295As reactantuspto-grants-2012_07
HRID 1517296 reaction equation
HRID 1517296As reactantuspto-grants-2012_07

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes