Basic information
- Standard SMILES
Cc1ccc(-c2c(C)nn3c(-c4ccc(F)cc4)cc(=O)[nH]c23)cc1- InChIKey
PBXKDWLWGNNDMT-UHFFFAOYSA-N- Molecular formula
- C20H16FN3O
- Average molar mass
- 333.4 g/mol
- Monoisotopic mass
- 333.1277403
Names & identifiers
- Preferred name
- 3-(4-methylphenyl)-7-(4-fluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidin-5(4H)-one
- IUPAC
- 7-(4-fluorophenyl)-2-methyl-3-(4-methylphenyl)-4H-pyrazolo[1,5-a]pyrimidin-5-one
Names & synonyms
SCHEMBL256944PBXKDWLWGNNDMT-UHFFFAOYSA-N3-(4-methylphenyl)-7-(4-fluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidin-5(4H)-one
Database identifiers
- PubChem CID
- 136393899
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 46.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 535
Related reactions
1 records
Compound notes
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