Basic information
- CAS
924011-60-9- Standard SMILES
CCCCCCOc1c2c(c(OCCCCCC)c3ccccc13)C(N)=NC2=N- InChIKey
LQTOYNWYPOMLOP-UHFFFAOYSA-N- Molecular formula
- C24H33N3O2
- Average molar mass
- 395.5 g/mol
- Monoisotopic mass
- 395.2572773
Names & identifiers
- Preferred name
- 4,9-Bis(hexyloxy)-1-imino-1H-benzo[f]isoindol-3-amine
- IUPAC
- 4,9-dihexoxy-3-iminobenzo[f]isoindol-1-amine
Names & synonyms
924011-60-94,9-Bis(hexyloxy)-1-imino-1H-benzo[f]isoindol-3-amineDTXSID50854070
Database identifiers
- CAS
924011-60-9- PubChem CID
- 71445554
- DTXSID
DTXSID50854070
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 80.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 12
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 550
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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