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2,5-Pyrrolidinedione, 1,1'-(1,2-ethanediyl)bis(3-(4-(1-methylethoxy)phenyl)-

HCID 3087705
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Basic information

CAS
115906-24-6
Standard SMILES
CC(C)Oc1ccc(C2CC(=O)N(CCN3C(=O)CC(c4ccc(OC(C)C)cc4)C3=O)C2=O)cc1
InChIKey
PLNKYRJDDSQFIL-UHFFFAOYSA-N
Molecular formula
C28H32N2O6
Average molar mass
492.6 g/mol
Monoisotopic mass
492.22603674

Names & identifiers

Preferred name
2,5-Pyrrolidinedione, 1,1'-(1,2-ethanediyl)bis(3-(4-(1-methylethoxy)phenyl)-
IUPAC
1-[2-[2,5-dioxo-3-(4-propan-2-yloxyphenyl)pyrrolidin-1-yl]ethyl]-3-(4-propan-2-yloxyphenyl)pyrrolidine-2,5-dione

Names & synonyms

BRN 56746981,1'-(1,2-Ethanediyl)bis(3-(4-(1-methylethoxy)phenyl)-2,5-pyrrolidinedione)115906-24-62,5-Pyrrolidinedione, 1,1'-(1,2-ethanediyl)bis(3-(4-(1-methylethoxy)phenyl)-RefChem:247761DTXSID609218431,1'-(Ethane-1,2-diyl)bis(3-{4-[(propan-2-yl)oxy]phenyl}pyrrolidine-2,5-dione)

Database identifiers

CAS
115906-24-6
PubChem CID
3087705
DTXSID
DTXSID60921843

Properties

Computed structural properties

XLogP
3
Topological polar surface area
93.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
36
Formal charge
0
Complexity
758

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Compound notes

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