2-Butyl-6-phenyl-1H-pyrazolo(1,2-a)cinnoline-1,3(2H)-dione
Basic information
- CAS
1523-45-1- Standard SMILES
CCCCC1C(=O)N2C=C(c3ccccc3)c3ccccc3N2C1=O- InChIKey
ZJJCMTPBBMBVPA-UHFFFAOYSA-N- Molecular formula
- C21H20N2O2
- Average molar mass
- 332.4 g/mol
- Monoisotopic mass
- 332.15247789
Names & identifiers
- Preferred name
- 2-Butyl-6-phenyl-1H-pyrazolo(1,2-a)cinnoline-1,3(2H)-dione
- IUPAC
- 2-butyl-6-phenylpyrazolo[1,2-a]cinnoline-1,3-dione
Names & synonyms
1523-45-1NSC287491NSC 2874912-Butyl-6-phenyl-1H-pyrazolo(1,2-a)cinnoline-1,3(2H)-dione2-Butyl-6-phenyl-1H-pyrazolo[1,2-a]cinnoline-1,3(2H)-dione2-butyl-6-phenyl-pyrazolo[1,2-a]cinnoline-1,3-dioneNSC-287491
Database identifiers
- CAS
1523-45-1- PubChem CID
- 323997
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 40.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 564
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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