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Compound
2-[2-Amino-6-(2,2-diphenylethylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
HCID
13686252
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Basic information
Standard SMILES
Nc1nc(NCC(c2ccccc2)c2ccccc2)c2ncn(C3OC(CO)C(O)C3O)c2n1
InChIKey
DWLRQCKPLTUZSI-UHFFFAOYSA-N
Molecular formula
C24H26N6O4
Average molar mass
462.5 g/mol
Names & identifiers
Preferred name
2-[2-Amino-6-(2,2-diphenylethylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
IUPAC
2-[2-amino-6-(2,2-diphenylethylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Database identifiers
PubChem CID
13686252
Properties
Computed structural properties
XLogP
2.7
Topological polar surface area
152 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
9
Rotatable bonds
7
Heavy atoms
34
Formal charge
0
Complexity
631
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Related reactions
1 records
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As product
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As solvent
HRID
669774
As product
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Compound notes
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