Basic information
- CAS
694498-02-7- Standard SMILES
Cc1ccc(F)c(NC(=O)c2c(-c3ccccc3)noc2C)c1- InChIKey
OKEPWJZMUDAYJU-UHFFFAOYSA-N- Molecular formula
- C18H15FN2O2
- Average molar mass
- 310.3 g/mol
- Monoisotopic mass
- 310.11175589
Names & identifiers
- Preferred name
- N-(2-fluoro-5-methylphenyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
- IUPAC
- N-(2-fluoro-5-methylphenyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
Names & synonyms
MLS001124889N-(2-fluoro-5-methylphenyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamideSMR000666055cid_975481CHEMBL1568718BDBM78402DTXSID601321902HMS2997H18AKOS001359206CCG-276310694498-02-7SR-01000269824
Show more names
SR-01000269824-1Z26862309N-(2-fluoro-5-methyl-phenyl)-5-methyl-3-phenyl-isoxazole-4-carboxamideN-(2-fluoro-5-methylphenyl)-5-methyl-3-phenyl-4-isoxazolecarboxamideN-(2-fluoranyl-5-methyl-phenyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
Database identifiers
- CAS
694498-02-7- PubChem CID
- 975481
- DTXSID
DTXSID601321902- ChEMBL
CHEMBL1568718
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 414
Experimental & physicochemical properties
Solubility2.2 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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