Brn 0588242
Basic information
- CAS
32850-17-2- Standard SMILES
CCC1(C)CC(=O)N(CN2CCN(CN3C(=O)CC(C)(CC)C3=O)C(C)C2)C1=O- InChIKey
QAKWHQCYOPJDHY-UHFFFAOYSA-N- Molecular formula
- C21H34N4O4
- Average molar mass
- 406.5 g/mol
- Monoisotopic mass
- 406.25800558
Names & identifiers
- Preferred name
- Brn 0588242
- IUPAC
- 3-ethyl-1-[[4-[(3-ethyl-3-methyl-2,5-dioxopyrrolidin-1-yl)methyl]-3-methylpiperazin-1-yl]methyl]-3-methylpyrrolidine-2,5-dione
Names & synonyms
BRN 058824232850-17-2N,N'-((2-Methyl-1,4-piperazinediyl)dimethylene)bis(2-ethyl-2-methylsuccinimide)5-23-03-00268 (Beilstein Handbook Reference)Succinimide, N,N'-((2-methyl-1,4-piperazinediyl)dimethylene)bis(2-ethyl-2-methyl-2 5-Pyrrolidinedione, 1,1'-((2-methyl-1,4-piperazinediyl)bis(methylene))bis(3-ethyl-3-methyl-RefChem:330208DTXSID009544981,1'-[(2-Methylpiperazine-1,4-diyl)bis(methylene)]bis(3-ethyl-3-methylpyrrolidine-2,5-dione)
Database identifiers
- CAS
32850-17-2- PubChem CID
- 208692
- DTXSID
DTXSID00954498
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 81.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 725
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Compound notes
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