2,3-Pyrrolidinedione, 4,4'-(1,2-ethanediylbis(imino(phenylmethylidyne)))bis(1-(3-bromophenyl)-5-thioxo-
Basic information
- CAS
107902-60-3- Standard SMILES
O=C1C(=O)N(c2cccc(Br)c2)C(=S)/C1=C(/NCCN/C(=C1\C(=O)C(=O)N(c2cccc(Br)c2)C1=S)c1ccccc1)c1ccccc1- InChIKey
NVGPVFWTFGHLEG-QAVVBOBSSA-N- Molecular formula
- C36H24Br2N4O4S2
- Average molar mass
- 800.5 g/mol
- Monoisotopic mass
- 797.96057
Names & identifiers
- Preferred name
- 2,3-Pyrrolidinedione, 4,4'-(1,2-ethanediylbis(imino(phenylmethylidyne)))bis(1-(3-bromophenyl)-5-thioxo-
- IUPAC
- (4E)-1-(3-bromophenyl)-4-[[2-[[(E)-[1-(3-bromophenyl)-4,5-dioxo-2-sulfanylidenepyrrolidin-3-ylidene]-phenylmethyl]amino]ethylamino]-phenylmethylidene]-5-sulfanylidenepyrrolidine-2,3-dione
Names & synonyms
107902-60-32,3-Pyrrolidinedione, 4,4'-(1,2-ethanediylbis(imino(phenylmethylidyne)))bis(1-(3-bromophenyl)-5-thioxo-RefChem:1059522
Database identifiers
- CAS
107902-60-3- PubChem CID
- 3065409
Properties
Computed structural properties
- XLogP
- 9
- Topological polar surface area
- 163 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 48
- Formal charge
- 0
- Complexity
- 1,300
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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