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Basic information
- Standard SMILES
Cc1cc(C2=CC(C)(c3cc(Cl)cc(Cl)c3)ON2C)ccc1C(N)=O- InChIKey
KLKYKWHOYYOPSG-UHFFFAOYSA-N- Molecular formula
- C19H18Cl2N2O2
- Average molar mass
- 377.3 g/mol
- Monoisotopic mass
- 376.0745332
Names & identifiers
- Preferred name
- 4-[5-(3,5-Dichloro-phenyl)-2,5-dimethyl-2,5-dihydro-isoxazol-3-yl]-2-methyl-benzamide
- IUPAC
- 4-[5-(3,5-dichlorophenyl)-2,5-dimethyl-1,2-oxazol-3-yl]-2-methylbenzamide
Names & synonyms
SCHEMBL14150899KLKYKWHOYYOPSG-UHFFFAOYSA-N4-[5-(3,5-Dichloro-phenyl)-2,5-dimethyl-2,5-dihydro-isoxazol-3-yl]-2-methyl-benzamide
Database identifiers
- PubChem CID
- 89262003
Properties
Computed structural propertiesFilling in
- XLogP
- 4.6
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 546
Related reactions
1 records
Compound notes
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