1-N,4-N-bis[(E)-(2,3-dimethoxyphenyl)methylideneamino]phthalazine-1,4-diamine
Basic information
- CAS
27818-65-1- Standard SMILES
COc1cccc(/C=N/Nc2nnc(N/N=C/c3cccc(OC)c3OC)c3ccccc23)c1OC- InChIKey
YFJUIJDONAIVMR-DPCVLPDWSA-N- Molecular formula
- C26H26N6O4
- Average molar mass
- 486.5 g/mol
- Monoisotopic mass
- 486.20155333
Names & identifiers
- Preferred name
- 1-N,4-N-bis[(E)-(2,3-dimethoxyphenyl)methylideneamino]phthalazine-1,4-diamine
- IUPAC
- 1-N,4-N-bis[(E)-(2,3-dimethoxyphenyl)methylideneamino]phthalazine-1,4-diamine
Names & synonyms
MLS002703792NSC103854NSC-103854
Database identifiers
- CAS
27818-65-1- PubChem CID
- 9568415
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 10
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 654
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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