Basic information
- Standard SMILES
Cc1ccc(Cl)cc1CNc1ccc2c(=O)[nH]nc(Cl)c2c1- InChIKey
FKOHKSOOLHGIJZ-UHFFFAOYSA-N- Molecular formula
- C16H13Cl2N3O
- Average molar mass
- 334.2 g/mol
Names & identifiers
- Preferred name
- 4-Chloro-6-(5-chloro-2-methyl-benzylamino)-2H-phthalazin-1-one
- IUPAC
- 4-chloro-6-[(5-chloro-2-methylphenyl)methylamino]-2H-phthalazin-1-one
Names & synonyms
SCHEMBL2462588FKOHKSOOLHGIJZ-UHFFFAOYSA-N4-Chloro-6-(5-chloro-2-methyl-benzylamino)-2H-phthalazin-1-one
Database identifiers
- PubChem CID
- 24946162
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 53.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 457
Related reactions
3 records
Compound notes
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