Basic information
- Standard SMILES
COc1c(C#N)c2cc(Cl)c(Cl)cc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O- InChIKey
IKGHOWMVAPWZBV-RGCMKSIDSA-N- Molecular formula
- C15H14Cl2N2O5
- Average molar mass
- 373.2 g/mol
Names & identifiers
- Preferred name
- 5,6-dichloro-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-methoxy-indole-3-carbonitrile
- IUPAC
- 5,6-dichloro-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methoxyindole-3-carbonitrile
Names & synonyms
SCHEMBL1627706IKGHOWMVAPWZBV-RGCMKSIDSA-N5,6-Dichloro-2-methoxy-3-cyano-1-(beta-D-ribofuranosyl)indole1H-Indole-3-carbonitrile, 5,6-dichloro-2-methoxy-1-b-D-ribofuranosyl-5,6-dichloro-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-methoxy-indole-3-carbonitrile
Database identifiers
- PubChem CID
- 11675158
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 517
Related reactions
4 records
Compound notes
Loading…