Basic information
- Standard SMILES
COC(=O)c1ccc(CCc2nc(-c3ccccc3)oc2C)cc1- InChIKey
KSRYOBKJSRHYRX-UHFFFAOYSA-N- Molecular formula
- C20H19NO3
- Average molar mass
- 321.4 g/mol
Names & identifiers
- Preferred name
- Methyl 4-[2-(5-methyl-2-phenyl-4-oxazolyl)ethyl]benzoate
- IUPAC
- methyl 4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethyl]benzoate
Names & synonyms
SCHEMBL7485443KSRYOBKJSRHYRX-UHFFFAOYSA-NMethyl 4-[2-(5-methyl-2-phenyl-4-oxazolyl)ethyl]benzoate
Database identifiers
- PubChem CID
- 19965620
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 400
Related reactions
2 records
Compound notes
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