5-[2-(4-chlorophenyl)ethyl]-6-(2-furyl)-1-(4-methylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
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Basic information
- CAS
901022-15-9- Standard SMILES
Cc1ccc(-n2ncc3c(=O)n(CCc4ccc(Cl)cc4)c(-c4ccco4)nc32)cc1- InChIKey
QPWPITWYUYHUPW-UHFFFAOYSA-N- Molecular formula
- C24H19ClN4O2
- Average molar mass
- 430.9 g/mol
- Monoisotopic mass
- 430.1196536
Names & identifiers
- Preferred name
- 5-[2-(4-chlorophenyl)ethyl]-6-(2-furyl)-1-(4-methylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
- IUPAC
- 5-[2-(4-chlorophenyl)ethyl]-6-(furan-2-yl)-1-(4-methylphenyl)pyrazolo[5,4-d]pyrimidin-4-one
- English name
- 5-[2-(4-chlorophenyl)ethyl]-6-(2-furyl)-1-(4-methylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
- Molecular formula
- C24H19ClN4O2
- Molecular weight
- 430.88626
Names & synonyms
5-[2-(4-chlorophenyl)ethyl]-6-(2-furyl)-1-(4-methylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-oneCCG-28693MFCD11503109AKOS001809501AP-064/432373065-[2-(4-chlorophenyl)ethyl]-6-(furan-2-yl)-1-(4-methylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one5-[2-(4-CHLOROPHENYL)ETHYL]-6-(FURAN-2-YL)-1-(4-METHYLPHENYL)-1H,4H,5H-PYRAZOLO[3,4-D]PYRIMIDIN-4-ONE5-[2-(4-chlorophenyl)ethyl]-6-(furan-2-yl)-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-one
Database identifiers
- CAS
901022-15-9- PubChem CID
- 16740363
Properties
Computed structural propertiesFilling in
- XLogP
- 5.2
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 672
Related reactions
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Compound notes
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