Basic information
- Standard SMILES
O=C(NCCCCCCCNC(=O)c1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2- InChIKey
HSHXBAWOJTVPPA-UHFFFAOYSA-N- Molecular formula
- C23H26N2O6
- Average molar mass
- 426.5 g/mol
Names & identifiers
- Preferred name
- N,N'-Heptamethylenebis(3,4-methylenedioxybenzamide)
- IUPAC
- N-[7-(1,3-benzodioxole-5-carbonylamino)heptyl]-1,3-benzodioxole-5-carboxamide
Names & synonyms
SCHEMBL11755841HSHXBAWOJTVPPA-UHFFFAOYSA-NAKOS003888177N,N'-Heptamethylenebis(3,4-methylenedioxybenzamide)
Database identifiers
- PubChem CID
- 4132789
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 95.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 553
Related reactions
1 records
Compound notes
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