Ethyl 2-[2-(4-chlorophenyl)-5-isobutyl-4-oxazolyl]acetate
Basic information
- Standard SMILES
CCOC(=O)Cc1nc(-c2ccc(Cl)cc2)oc1CC(C)C- InChIKey
WMFUZTVBOBNASY-UHFFFAOYSA-N- Molecular formula
- C17H20ClNO3
- Average molar mass
- 321.8 g/mol
- Monoisotopic mass
- 321.1131712
Names & identifiers
- Preferred name
- Ethyl 2-[2-(4-chlorophenyl)-5-isobutyl-4-oxazolyl]acetate
- IUPAC
- ethyl 2-[2-(4-chlorophenyl)-5-(2-methylpropyl)-1,3-oxazol-4-yl]acetate
Names & synonyms
SCHEMBL11003496WMFUZTVBOBNASY-UHFFFAOYSA-Nethyl 2-[2-(4-chlorophenyl)-5-isobutyl-4-oxazolyl]acetate
Database identifiers
- PubChem CID
- 13488809
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 356
Related reactions
1 records
Compound notes
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