1-{2-[2-(4-Bromo-phenyl)-5-methyl-oxazol-4-yl]-ethyl}-piperidine
Basic information
- Standard SMILES
Cc1oc(-c2ccc(Br)cc2)nc1CCN1CCCCC1- InChIKey
JOMAJALOGDGCDX-UHFFFAOYSA-N- Molecular formula
- C17H21BrN2O
- Average molar mass
- 349.3 g/mol
- Monoisotopic mass
- 348.08373
Names & identifiers
- Preferred name
- 1-{2-[2-(4-Bromo-phenyl)-5-methyl-oxazol-4-yl]-ethyl}-piperidine
- IUPAC
- 2-(4-bromophenyl)-5-methyl-4-(2-piperidin-1-ylethyl)-1,3-oxazole
Names & synonyms
SCHEMBL3582924JOMAJALOGDGCDX-UHFFFAOYSA-N1-{2-[2-(4-bromo-phenyl)-5-methyl-oxazol-4-yl]-ethyl}-piperidine(+/-)-1-{2-[2-(4-bromo-phenyl)-5-methyl-oxazol-4-yl]-ethyl}-piperidine
Database identifiers
- PubChem CID
- 11660292
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 314
Related reactions
7 records
Compound notes
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