Basic information
- Standard SMILES
Cc1nc2cccc(Br)c2cc1OC[C@@H](O)COCc1ccccc1- InChIKey
XNTBRRIWVZAKRW-INIZCTEOSA-N- Molecular formula
- C20H20BrNO3
- Average molar mass
- 402.3 g/mol
Names & identifiers
- Preferred name
- (2s)-1-(Benzyloxy)-3-[(5-bromo-2-methyl-quinolinyl)oxy]-2-propanol
- IUPAC
- (2S)-1-(5-bromo-2-methylquinolin-3-yl)oxy-3-phenylmethoxypropan-2-ol
Names & synonyms
SCHEMBL6778134XNTBRRIWVZAKRW-INIZCTEOSA-N(2s)-1-(benzyloxy)-3-[(5-bromo-2-methyl-quinolinyl)oxy]-2-propanol
Database identifiers
- PubChem CID
- 69893205
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 391
Related reactions
1 records
Compound notes
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