4-amino-7-fluoro-8-phenyl-N-propyl-cinnoline-3-carboxamide
Basic information
- Standard SMILES
CCCNC(=O)c1nnc2c(-c3ccccc3)c(F)ccc2c1N- InChIKey
UTLPDTOXOFRETH-UHFFFAOYSA-N- Molecular formula
- C18H17FN4O
- Average molar mass
- 324.4 g/mol
- Monoisotopic mass
- 324.13863934
Names & identifiers
- Preferred name
- 4-amino-7-fluoro-8-phenyl-N-propyl-cinnoline-3-carboxamide
- IUPAC
- 4-amino-7-fluoro-8-phenyl-N-propylcinnoline-3-carboxamide
Names & synonyms
SCHEMBL1964694UTLPDTOXOFRETH-UHFFFAOYSA-N4-amino-7-fluoro-8-phenyl-N-propyl-cinnoline-3-carboxamide
Database identifiers
- PubChem CID
- 24905979
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 429
Related reactions
1 records
Compound notes
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