Chemical ID: 4860777

CCN(CC)CCN1C(C(=C(C1=O)O)C(=O)c2ccccc2)c3cccc(c3)OCC=C
Chemical ID:
4860777
Name [?]:
5-(3-allyloxyphenyl)-4-benzoyl-1-(2-diethylaminoethyl)-3-hydroxy-5H-pyrrol-2-one
SMILES [?]:
CCN(CC)CCN1C(C(=C(C1=O)O)C(=O)c2ccccc2)c3cccc(c3)OCC=C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H30N2O4
All Atoms:32
Heavy Atoms:32
Chiral Atoms:1
ZAP Information [?]
Total:12.0333
Area:689.854
Solvation:-5.21306
Coulombic:-58.5478
Bond Count [?]
All:34
Single:24
Double:10
Rotors:11
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:434.527
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:4.43
LogP (Chemaxon):0.81

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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