N-[4-(benzyloxy)-3-chlorophenyl]-5H-pyrrolo[3,2-d]pyrimidin-4-amine

HCID 57597271
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Basic information

Standard SMILES
Clc1cc(Nc2ncnc3cc[nH]c23)ccc1OCc1ccccc1
InChIKey
DOXIHOYCABUAOZ-UHFFFAOYSA-N
Molecular formula
C19H15ClN4O
Average molar mass
350.8 g/mol

Names & identifiers

Preferred name
N-[4-(benzyloxy)-3-chlorophenyl]-5H-pyrrolo[3,2-d]pyrimidin-4-amine
IUPAC
N-(3-chloro-4-phenylmethoxyphenyl)-5H-pyrrolo[3,2-d]pyrimidin-4-amine

Names & synonyms

SCHEMBL2748537DOXIHOYCABUAOZ-UHFFFAOYSA-NN-[4-(benzyloxy)-3-chlorophenyl]-5H-pyrrolo[3,2-d]pyrimidin-4-amine

Database identifiers

PubChem CID
57597271

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
62.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
25

Related reactions

3 records
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Compound notes

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