Basic information
- Standard SMILES
CCC(CC)OCc1c(O[C@H](Cn2ccnc2)c2ccccc2)ccc2c1CCCC2=O- InChIKey
HDKUYMVQFJAPQX-HHHXNRCGSA-N- Molecular formula
- C27H32N2O3
- Average molar mass
- 432.6 g/mol
Names & identifiers
- Preferred name
- 5-(1-Ethyl-propoxymethyl)-6-((S)-2-imidazol-1-yl-1-phenyl-ethoxy)-3,4-dihydro-2H-naphthalen-1-one
- IUPAC
- 6-[(1S)-2-imidazol-1-yl-1-phenylethoxy]-5-(pentan-3-yloxymethyl)-3,4-dihydro-2H-naphthalen-1-one
Names & synonyms
SCHEMBL6301825HDKUYMVQFJAPQX-HHHXNRCGSA-N5-(1-Ethyl-propoxymethyl)-6-((S)-2-imidazol-1-yl-1-phenyl-ethoxy)-3,4-dihydro-2H-naphthalen-1-one
Database identifiers
- PubChem CID
- 60029940
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 575
Related reactions
1 records
Compound notes
Loading…