8-(4'-Methylbiphenyl-4-ylmethylamino)adenosine
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Basic information
- Standard SMILES
Cc1ccc(-c2ccc(CNc3nc4c(N)ncnc4n3[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)cc1- InChIKey
UVTUXOSOKLJPDF-ZDXOVATRSA-N- Molecular formula
- C24H26N6O4
- Average molar mass
- 462.5 g/mol
- Monoisotopic mass
- 462.20155333
Names & identifiers
- Preferred name
- 8-(4'-Methylbiphenyl-4-ylmethylamino)adenosine
- IUPAC
- (2R,3R,4S,5R)-2-[6-amino-8-[[4-(4-methylphenyl)phenyl]methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Names & synonyms
SCHEMBL2572253UVTUXOSOKLJPDF-ZDXOVATRSA-N8-(4'-Methylbiphenyl-4-ylmethylamino)adenosine
Database identifiers
- PubChem CID
- 11612348
Properties
Computed structural propertiesFilling in
- XLogP
- 2.8
- Topological polar surface area
- 152 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 659
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Related reactions
1 records
Compound notes
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