1-N,4-N-bis[(3,4-diethoxyphenyl)methylideneamino]phthalazine-1,4-diamine
Basic information
- CAS
27704-11-6- Standard SMILES
CCOc1ccc(C=NNc2nnc(NN=Cc3ccc(OCC)c(OCC)c3)c3ccccc23)cc1OCC- InChIKey
TWIBBTZPAQPSJA-UHFFFAOYSA-N- Molecular formula
- C30H34N6O4
- Average molar mass
- 542.6 g/mol
- Monoisotopic mass
- 542.26415359
Names & identifiers
- Preferred name
- 1-N,4-N-bis[(3,4-diethoxyphenyl)methylideneamino]phthalazine-1,4-diamine
- IUPAC
- 1-N,4-N-bis[(3,4-diethoxyphenyl)methylideneamino]phthalazine-1,4-diamine
Names & synonyms
27704-11-6DTXSID509504001,4-Bis{[(3,4-diethoxyphenyl)methylidene]hydrazinylidene}-1,2,3,4-tetrahydrophthalazine
Database identifiers
- CAS
27704-11-6- PubChem CID
- 266240
- DTXSID
DTXSID50950400
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 14
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 710
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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