Basic information
- CAS
27702-21-2- Standard SMILES
Clc1ccc(C=NNc2nnc(NN=Cc3ccc(Cl)cc3Cl)c3ccccc23)c(Cl)c1- InChIKey
BOSNPRPXIPPMRV-UHFFFAOYSA-N- Molecular formula
- C22H14Cl4N6
- Average molar mass
- 504.2 g/mol
- Monoisotopic mass
- 502.003405
Names & identifiers
- Preferred name
- 1-N,4-N-bis[(2,4-dichlorophenyl)methylideneamino]phthalazine-1,4-diamine
- IUPAC
- 1-N,4-N-bis[(2,4-dichlorophenyl)methylideneamino]phthalazine-1,4-diamine
Names & synonyms
27702-21-2DTXSID109503801,4-Bis{[(2,4-dichlorophenyl)methylidene]hydrazinylidene}-1,2,3,4-tetrahydrophthalazine
Database identifiers
- CAS
27702-21-2- PubChem CID
- 266258
- DTXSID
DTXSID10950380
Properties
Computed structural properties
- XLogP
- 7.5
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 598
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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