Chemical ID: 5705616

Cc1ccc(cc1)C(=C2C(N(C(=O)C2=O)CCCOC)c3ccc(cc3)N(=O)=O)O
Chemical ID:
5705616
Name [?]:
4-[hydroxy-(p-tolyl)methylene]-1-(3-methoxypropyl)-5-(4-nitrophenyl)-pyrrolidine-2,3-dione
SMILES [?]:
Cc1ccc(cc1)C(=C2C(N(C(=O)C2=O)CCCOC)c3ccc(cc3)N(=O)=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H22N2O6
All Atoms:30
Heavy Atoms:30
Chiral Atoms:1
ZAP Information [?]
Total:4.53499
Area:610.057
Solvation:-10.7164
Coulombic:-63.5776
Bond Count [?]
All:32
Single:21
Double:11
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:410.42
H-Bond Donors:1
H-Bond Acceptors:8
XLogP:3.05
LogP (Chemaxon):2.08

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Experimental Annotations

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Descriptor Annotations

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