Basic information
- CAS
717859-26-2- Standard SMILES
Cc1cc(F)ccc1NC(=O)c1c(C)noc1C- InChIKey
AFBZXOUNLDRDGD-UHFFFAOYSA-N- Molecular formula
- C13H13FN2O2
- Average molar mass
- 248.25 g/mol
- Monoisotopic mass
- 248.09610582
Names & identifiers
- Preferred name
- N-(4-fluoro-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-carboxamide
- IUPAC
- N-(4-fluoro-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-carboxamide
- English name
- 4-Isoxazolecarboxamide,N-(4-fluoro-2-methylphenyl)-3,5-dimethyl-(9CI)
- Molecular formula
- C13H13FN2O2
- Molecular weight
- 248.25
Names & synonyms
N-(4-fluoro-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-carboxamideSTK461724AKOS003361719ST50870594(3,5-dimethylisoxazol-4-yl)-N-(4-fluoro-2-methylphenyl)carboxamideN-(4-FLUORO-2-METHYLPHENYL)-3,5-DIMETHYL-4-ISOXAZOLECARBOXAMIDE4-Isoxazolecarboxamide, N-(4-fluoro-2-methylphenyl)-3,5-dimethyl-4-Isoxazolecarboxamide,N-(4-fluoro-2-methylphenyl)-3,5-dimethyl-(9CI)
Database identifiers
- CAS
717859-26-2- PubChem CID
- 1245570
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 313
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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