Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
OCCCCOc1cc(CNc2nc3ccccc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc(-c2ccccc2)c1- InChIKey
MCXNYPSGQNEUSH-BIYDSLDMSA-N- Molecular formula
- C29H33N3O6
- Average molar mass
- 519.6 g/mol
Names & identifiers
- Preferred name
- 2-[3-(4-Hydroxybutoxy)-5-phenylbenzylamino]-1-(beta-D-ribofuranosyl)-1H-benzimidazole
- IUPAC
- (2R,3R,4S,5R)-2-[2-[[3-(4-hydroxybutoxy)-5-phenylphenyl]methylamino]benzimidazol-1-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Names & synonyms
SCHEMBL3925024MCXNYPSGQNEUSH-BIYDSLDMSA-N2-[3-(4-Hydroxybutoxy)-5-phenylbenzylamino]-1-(beta-D-ribofuranosyl)-1H-benzimidazole
Database identifiers
- PubChem CID
- 57720157
Properties
Computed structural propertiesFilling in
- XLogP
- 3.3
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 712
Related reactions
1 records
Compound notes
Loading…