Basic information
- Standard SMILES
C=C(C)CC(O)(CCN[C@@H](C)c1ccc(Br)cc1)c1ccccc1- InChIKey
YVOXECRJUVAGTB-PBVYKCSPSA-N- Molecular formula
- C21H26BrNO
- Average molar mass
- 388.3 g/mol
Names & identifiers
- Preferred name
- 1-((S)-1-(4-bromophenyl)ethylamino)-5-methyl-3-phenylhex-5-en-3-ol
- IUPAC
- 1-[[(1S)-1-(4-bromophenyl)ethyl]amino]-5-methyl-3-phenylhex-5-en-3-ol
Names & synonyms
SCHEMBL117417YVOXECRJUVAGTB-PBVYKCSPSA-N1-((S)-1-(4-bromophenyl)ethylamino)-5-methyl-3-phenylhex-5-en-3-ol
Database identifiers
- PubChem CID
- 59635665
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 385
Related reactions
8 records
Compound notes
Loading…