2-Methyl-5-(5-methyl-3-phenyl-isoxazol-4-ylmethoxy)-2H-pyrazole-3-carboxylic acid (tetra-hydro-pyran-4-yl)-amide
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Basic information
- Standard SMILES
Cc1onc(-c2ccccc2)c1COc1cc(C(=O)NC2CCOCC2)n(C)n1- InChIKey
QOCFAOFLUOEORL-UHFFFAOYSA-N- Molecular formula
- C21H24N4O4
- Average molar mass
- 396.4 g/mol
Names & identifiers
- Preferred name
- 2-Methyl-5-(5-methyl-3-phenyl-isoxazol-4-ylmethoxy)-2H-pyrazole-3-carboxylic acid (tetra-hydro-pyran-4-yl)-amide
- IUPAC
- 1-methyl-3-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-N-(oxan-4-yl)pyrazole-5-carboxamide
Names & synonyms
SCHEMBL286157QOCFAOFLUOEORL-UHFFFAOYSA-N2-Methyl-5-(5-methyl-3-phenyl-isoxazol-4-ylmethoxy)-2H-pyrazole-3-carboxylic acid (tetra-hydro-pyran-4-yl)-amide
Database identifiers
- PubChem CID
- 49792995
Properties
Computed structural propertiesFilling in
- XLogP
- 2.6
- Topological polar surface area
- 91.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 539
Related reactions
1 records
Compound notes
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