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Basic information
- Standard SMILES
Cc1oc(-c2ccc(-c3ccc(S(C)(=O)=O)cc3)cc2F)nc1CCN1CCCC1C- InChIKey
FVDZPPXQHHXRFL-UHFFFAOYSA-N- Molecular formula
- C24H27FN2O3S
- Average molar mass
- 442.5 g/mol
- Monoisotopic mass
- 442.17264206
Names & identifiers
- Preferred name
- 2-(3-Fluoro-4'-methanesulfonyl-biphenyl-4-yl)-5-methyl-4-[2-(2-methyl-pyrrolidin-1-yl)-ethyl]-oxazole
- IUPAC
- 2-[2-fluoro-4-(4-methylsulfonylphenyl)phenyl]-5-methyl-4-[2-(2-methylpyrrolidin-1-yl)ethyl]-1,3-oxazole
Names & synonyms
SCHEMBL3589130FVDZPPXQHHXRFL-UHFFFAOYSA-N2-(3-Fluoro-4'-methanesulfonyl-biphenyl-4-yl)-5-methyl-4-[2-(2-methyl-pyrrolidin-1-yl)-ethyl]-oxazole
Database identifiers
- PubChem CID
- 11626403
Properties
Computed structural propertiesFilling in
- XLogP
- 4.6
- Topological polar surface area
- 71.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 691
Related reactions
1 records
Compound notes
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