Basic information
- Standard SMILES
Cc1cc(C(=O)N2CC(Oc3ccccc3C(C)(C)C)C2)no1- InChIKey
DGVMZGLGJARTTO-UHFFFAOYSA-N- Molecular formula
- C18H22N2O3
- Average molar mass
- 314.4 g/mol
- Monoisotopic mass
- 314.16304257
Names & identifiers
- Preferred name
- (3-(2-Tert-butylphenoxy)azetidin-1-yl)(5-methylisoxazol-3-yl)methanone
- IUPAC
- [3-(2-tert-butylphenoxy)azetidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
Names & synonyms
SCHEMBL3103677DGVMZGLGJARTTO-UHFFFAOYSA-N(3-(2-tert-butylphenoxy)azetidin-1-yl)(5-methylisoxazol-3-yl)methanone
Database identifiers
- PubChem CID
- 59577162
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 428
Related reactions
2 records
Compound notes
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