Basic information
- Standard SMILES
OCCCCNc1cccc(CNc2nc3ccccc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1- InChIKey
CODIALDHXUJIRY-GXRSIYKFSA-N- Molecular formula
- C23H30N4O5
- Average molar mass
- 442.5 g/mol
Names & identifiers
- Preferred name
- 2-[3-(4-Hydroxybutylamino)benzylamino]-1-(beta-D-ribofuranosyl)-1H-benzimidazole
- IUPAC
- (2R,3R,4S,5R)-2-[2-[[3-(4-hydroxybutylamino)phenyl]methylamino]benzimidazol-1-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Names & synonyms
SCHEMBL3926869CODIALDHXUJIRY-GXRSIYKFSA-N2-[3-(4-Hydroxybutylamino)benzylamino]-1-(beta-D-ribofuranosyl)-1H-benzimidazole
Database identifiers
- PubChem CID
- 57720195
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 573
Related reactions
1 records
Compound notes
Loading…