tert-Butyl 6-amino-4-(2-furyl)-1H-pyrazolo[3,4-d]pyrimidine-1-carboxylate

HCID 22015534
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Basic information

Standard SMILES
CC(C)(C)OC(=O)n1ncc2c(-c3ccco3)nc(N)nc21
InChIKey
NSDQAFLOEUBCJX-UHFFFAOYSA-N
Molecular formula
C14H15N5O3
Average molar mass
301.3 g/mol

Names & identifiers

Preferred name
tert-Butyl 6-amino-4-(2-furyl)-1H-pyrazolo[3,4-d]pyrimidine-1-carboxylate
IUPAC
tert-butyl 6-amino-4-(furan-2-yl)pyrazolo[3,4-d]pyrimidine-1-carboxylate

Names & synonyms

SCHEMBL4454416NSDQAFLOEUBCJX-UHFFFAOYSA-Ntert-Butyl 6-amino-4-(2-furyl)-1H-pyrazolo[3,4-d]pyrimidine-1-carboxylate

Database identifiers

PubChem CID
22015534

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
109 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
22

Related reactions

6 records
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Compound notes

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