Basic information
- Standard SMILES
CC(C)(O)Cn1c(CO)nc2c(N)nc3ccccc3c21- InChIKey
VLKIKVURNOPTAU-UHFFFAOYSA-N- Molecular formula
- C15H18N4O2
- Average molar mass
- 286.33 g/mol
- Monoisotopic mass
- 286.14297583
Names & identifiers
- Preferred name
- O-Desethyl Resiquimod
- IUPAC
- 1-[4-amino-2-(hydroxymethyl)imidazo[4,5-c]quinolin-1-yl]-2-methylpropan-2-ol
Names & synonyms
O-Desethyl Resiquimod144875-23-04-Amino-2-(hydroxymethyl)-a,a-dimethyl-1H-imidazo[4,5-c]quinoline-1-ethanol;SCHEMBL4311969SCHEMBL31126374VLKIKVURNOPTAU-UHFFFAOYSA-N1-(4-amino-2-hydroxymethyl-1H-imidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol
Database identifiers
- PubChem CID
- 9817345
- Nikkaji
- J1.208.963E
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 97.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 379
Related reactions
2 records
Compound notes
Loading…