3-(4'-Chloro-6-fluoro-4-methyl-biphenyl-3-yl)-4-hydroxy-8-methoxy-1,8-diazaspiro[4.5]dec-3-en-2-one
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Basic information
- Standard SMILES
CON1CCC2(CC1)NC(=O)C(c1cc(-c3ccc(Cl)cc3)c(F)cc1C)=C2O- InChIKey
CVGVCCKMQHWUPN-UHFFFAOYSA-N- Molecular formula
- C22H22ClFN2O3
- Average molar mass
- 416.9 g/mol
- Monoisotopic mass
- 416.1302984
Names & identifiers
- Preferred name
- 3-(4'-Chloro-6-fluoro-4-methyl-biphenyl-3-yl)-4-hydroxy-8-methoxy-1,8-diazaspiro[4.5]dec-3-en-2-one
- IUPAC
- 3-[5-(4-chlorophenyl)-4-fluoro-2-methylphenyl]-4-hydroxy-8-methoxy-1,8-diazaspiro[4.5]dec-3-en-2-one
Names & synonyms
SCHEMBL248033CVGVCCKMQHWUPN-UHFFFAOYSA-N3-(4'-chloro-6-fluoro-4-methyl-biphenyl-3-yl)-4-hydroxy-8-methoxy-1,8-diaza-spiro[4.5]dec-3-en-2-one3-(4'-Chloro-6-fluoro-4-methyl-biphenyl-3-yl)-4-hydroxy-8-methoxy-1,8-diazaspiro[4.5]dec-3-en-2-one
Database identifiers
- PubChem CID
- 59614583
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 656
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Related reactions
6 records
Compound notes
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