Basic information
- Standard SMILES
Cc1n[nH]c(=O)c2c(Nc3ccccc3Cl)c(F)c(F)cc12- InChIKey
DRDARDWYMCMFJM-UHFFFAOYSA-N- Molecular formula
- C15H10ClF2N3O
- Average molar mass
- 321.71 g/mol
Names & identifiers
- Preferred name
- 8-(2-chlorophenylamino)-6,7-difluoro-4-methyl-2H-phthalazin-1-one
- IUPAC
- 8-(2-chloroanilino)-6,7-difluoro-4-methyl-2H-phthalazin-1-one
Names & synonyms
SCHEMBL2429103DRDARDWYMCMFJM-UHFFFAOYSA-N8-(2-chlorophenylamino)-6,7-difluoro-4-methyl-2H-phthalazin-1-one
Database identifiers
- PubChem CID
- 67404366
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 53.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 476
Related reactions
3 records
Compound notes
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