Basic information
- CAS
91480-74-9- Standard SMILES
CCCOC(=O)/C=C/C(=O)N1CC(C)N(C(=O)/C=C/C(=O)OCCC)CC1C- InChIKey
FEGBEVVXIMRMSX-FIFLTTCUSA-N- Molecular formula
- C20H30N2O6
- Average molar mass
- 394.5 g/mol
- Monoisotopic mass
- 394.21038668
Names & identifiers
- Preferred name
- propyl (E)-4-[2,5-dimethyl-4-[(E)-4-oxo-4-propoxybut-2-enoyl]piperazin-1-yl]-4-oxobut-2-enoate
- IUPAC
- propyl (E)-4-[2,5-dimethyl-4-[(E)-4-oxo-4-propoxybut-2-enoyl]piperazin-1-yl]-4-oxobut-2-enoate
Names & synonyms
NSC34395991480-74-9NSC-343959Dipropyl (2E,2'E)-4,4'-(2,5-dimethylpiperazine-1,4-diyl)bis(4-oxobut-2-enoate)propyl (E)-4-[2,5-dimethyl-4-[(E)-4-oxo-4-propoxy-but-2-enoyl]piperazin-1-yl]-4-oxo-but-2-enoate
Database identifiers
- CAS
91480-74-9- PubChem CID
- 6369331
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 93.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 574
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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