Basic information
- Standard SMILES
O=c1[nH]nc(Cl)c2cc(NCc3cccc(N4CCOCC4)c3)ccc12- InChIKey
SPSBZNJMQFEZBD-UHFFFAOYSA-N- Molecular formula
- C19H19ClN4O2
- Average molar mass
- 370.8 g/mol
- Monoisotopic mass
- 370.1196536
Names & identifiers
- Preferred name
- 4-Chloro-6-(3-morpholin-4-yl-benzylamino)-2H-phthalazin-1-one
- IUPAC
- 4-chloro-6-[(3-morpholin-4-ylphenyl)methylamino]-2H-phthalazin-1-one
Names & synonyms
SCHEMBL2465567SPSBZNJMQFEZBD-UHFFFAOYSA-N4-Chloro-6-(3-morpholin-4-yl-benzylamino)-2H-phthalazin-1-one
Database identifiers
- PubChem CID
- 24945979
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 538
Related reactions
3 records
Compound notes
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