Basic information
- Standard SMILES
Br.Br.CCCCCCCCNc1cc(C)nc2ccc(O)cc12.CCCCCCCCNc1cc(C)nc2ccc(O)cc12.O- InChIKey
MDQVINCUPWMVLZ-UHFFFAOYSA-N- Molecular formula
- C36H56Br2N4O3
- Average molar mass
- 752.7 g/mol
Names & identifiers
- Preferred name
- 2-Methyl-4-octylaminoquinolin-6-ol hydrobromide hemihydrate
- IUPAC
- bis(2-methyl-4-(octylamino)quinolin-6-ol);hydrate;dihydrobromide
Names & synonyms
SCHEMBL9069482MDQVINCUPWMVLZ-UHFFFAOYSA-N2-methyl-4-octylaminoquinolin-6-ol hydrobromide hemihydrate
Database identifiers
- PubChem CID
- 67765014
Properties
Computed structural properties
- Topological polar surface area
- 91.3 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 16
- Heavy atoms
- 45
- Formal charge
- 0
- Complexity
- 284
Related reactions
1 records
Compound notes
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