9-((3aR,4R,6R,6aR)-6-((isopropylamino)methyl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)-9H-purin-6-amine

HCID 67975342

Basic information

Standard SMILES
CC(C)NC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H]2OC(C)(C)O[C@@H]21
InChIKey
ZOFBJGISBKLNQV-SDBHATRESA-N
Molecular formula
C16H24N6O3
Average molar mass
348.4 g/mol

Names & identifiers

Preferred name
9-((3aR,4R,6R,6aR)-6-((isopropylamino)methyl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)-9H-purin-6-amine
IUPAC
9-[(3aR,4R,6R,6aR)-2,2-dimethyl-6-[(propan-2-ylamino)methyl]-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-amine

Names & synonyms

SCHEMBL9940427ZOFBJGISBKLNQV-SDBHATRESA-N9-((3aR,4R,6R,6aR)-6-((isopropylamino)methyl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)-9H-purin-6-amine

Database identifiers

PubChem CID
67975342

Properties

Computed structural properties

XLogP
0.2
Topological polar surface area
109 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
4
Heavy atoms
25

Related reactions

4 records

Compound notes

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