1-(4-Acetylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidine-2,5-dione
Basic information
- CAS
6043-64-7- Standard SMILES
CC(=O)c1ccc(N2C(=O)CC(N3CCN(c4ccccn4)CC3)C2=O)cc1- InChIKey
VVGPLPYNNXMQHZ-UHFFFAOYSA-N- Molecular formula
- C21H22N4O3
- Average molar mass
- 378.4 g/mol
- Monoisotopic mass
- 378.16919058
Names & identifiers
- Preferred name
- 1-(4-Acetylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidine-2,5-dione
- IUPAC
- 1-(4-acetylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidine-2,5-dione
Names & synonyms
6043-64-71-(4-acetylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidine-2,5-dione1-(4-acetylphenyl)-3-[4-(2-pyridinyl)-1-piperazinyl]-2,5-pyrrolidinedione1-(4-ACETYLPHENYL)-3-[4-(PYRIDIN-2-YL)PIPERAZIN-1-YL]PYRROLIDINE-2,5-DIONECBMicro_043841Cambridge id 6043647DTXSID90387135MFCD01975320AKOS001736248BIM-0043857.P001SR-01000520493SR-01000520493-1
Database identifiers
- CAS
6043-64-7- PubChem CID
- 2881972
- DTXSID
DTXSID90387135
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 73.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 609
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Compound notes
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