Chemical ID: 5668385

COCCN1C(C(=C(c2ccc(cc2)Cl)O)C(=O)C1=O)c3ccc(c(c3)OC)O
Chemical ID:
5668385
Name [?]:
4-[(4-chlorophenyl)-hydroxy-methylene]-5-(4-hydroxy-3-methoxy-phenyl)-1-(2-methoxyethyl)pyrrolidine-2,3-dione
SMILES [?]:
COCCN1C(C(=C(c2ccc(cc2)Cl)O)C(=O)C1=O)c3ccc(c(c3)OC)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H20ClNO6
All Atoms:29
Heavy Atoms:29
Chiral Atoms:1
ZAP Information [?]
Total:7.34624
Area:559.176
Solvation:-6.63316
Coulombic:-75.1311
Bond Count [?]
All:31
Single:22
Double:9
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:417.839
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:2.5
LogP (Chemaxon):1.59

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Experimental Annotations

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Descriptor Annotations

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