1-[3-[(E)-3-[4-[(E)-3-[3-(2,5-dioxopyrrolidin-1-yl)phenyl]-3-oxoprop-1-enyl]phenyl]prop-2-enoyl]phenyl]pyrrolidine-2,5-dione
Basic information
- CAS
5187-14-4- Standard SMILES
O=C(/C=C/c1ccc(/C=C/C(=O)c2cccc(N3C(=O)CCC3=O)c2)cc1)c1cccc(N2C(=O)CCC2=O)c1- InChIKey
VEAJHXZNVZGQGH-PHEQNACWSA-N- Molecular formula
- C32H24N2O6
- Average molar mass
- 532.5 g/mol
- Monoisotopic mass
- 532.16343649
Names & identifiers
- Preferred name
- 1-[3-[(E)-3-[4-[(E)-3-[3-(2,5-dioxopyrrolidin-1-yl)phenyl]-3-oxoprop-1-enyl]phenyl]prop-2-enoyl]phenyl]pyrrolidine-2,5-dione
- IUPAC
- 1-[3-[(E)-3-[4-[(E)-3-[3-(2,5-dioxopyrrolidin-1-yl)phenyl]-3-oxoprop-1-enyl]phenyl]prop-2-enoyl]phenyl]pyrrolidine-2,5-dione
Names & synonyms
5187-14-4STK000177ZINC598242611,1'-{1,4-phenylenebis[(3-oxo-1-propene-1,3-diyl)-3,1-phenylene]}di(2,5-pyrrolidinedione)1-[3-[(E)-3-[4-[(E)-3-[3-(2,5-dioxopyrrolidin-1-yl)phenyl]-3-oxoprop-1-enyl]phenyl]prop-2-enoyl]phenyl]pyrrolidine-2,5-dioneDTXSID80416721SMSF0004297MFCD00306186AKOS003245308CB04323BIM-0013363.P001ZINC000059824261
Show more names
11(BENZENE14DIYLBIS(((1E)3OXOPROP1ENE13DIYL)BENZENE31DIYL))DIPYRROLIDINE25DIONEO=C1CCC(=O)N1c1cccc(c1)C(=O)C=Cc1ccc(cc1)C=CC(=O)c1cccc(c1)N1C(=O)CCC1=O1(3((E)3(4((E)3(3(25DIOXOPYRROLIDIN1YL)PHENYL)3OXOPROP1ENYL)PHENYL)PROP2ENOYL)PHENYL)PYRROLIDINE25DIONE1,1'-(1,4-Phenylenebis{[(1E)-3-oxoprop-1-ene-1,3-diyl]-3,1-phenylene})di(pyrrolidine-2,5-dione)C1CC(=O)N(C1=O)C2=CC=CC(=C2)C(=O)C=CC3=CC=C(C=C3)C=CC(=O)C4=CC(=CC=C4)N5C(=O)CCC5=O
Database identifiers
- CAS
5187-14-4- PubChem CID
- 5337774
- DTXSID
DTXSID80416721
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 983
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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