6-(4-Hydroxy-3-methoxybenzylamino)-9-(tetrahydrofuran-2-yl)-purine

HCID 44129503
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Basic information

Standard SMILES
COc1cc(CNc2ncnc3c2ncn3C2CCCO2)ccc1O
InChIKey
DUVOICBNUVYPIL-UHFFFAOYSA-N
Molecular formula
C17H19N5O3
Average molar mass
341.4 g/mol

Names & identifiers

Preferred name
6-(4-Hydroxy-3-methoxybenzylamino)-9-(tetrahydrofuran-2-yl)-purine
IUPAC
2-methoxy-4-[[[9-(oxolan-2-yl)purin-6-yl]amino]methyl]phenol

Names & synonyms

CHEMBL476242SCHEMBL2002143DUVOICBNUVYPIL-UHFFFAOYSA-N6-(4-hydroxy-3-methoxybenzylamino)-9-(tetrahydrofuran-2-yl)-purine

Database identifiers

PubChem CID
44129503
ChEMBL
CHEMBL476242

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
94.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
25

Related reactions

3 records
New reaction record

Compound notes

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