Chemical ID: 4419716

CCN(CC)CCN1C(C(=C(C1=O)O)C(=O)c2ccc(cc2)F)c3cccc(c3)[N+](=O)[O-]
Chemical ID:
4419716
Name [?]:
1-(2-diethylaminoethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-5H-pyrrol-2-one
SMILES [?]:
CCN(CC)CCN1C(C(=C(C1=O)O)C(=O)c2ccc(cc2)F)c3cccc(c3)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H24FN3O5
All Atoms:32
Heavy Atoms:32
Chiral Atoms:1
ZAP Information [?]
Total:5.87755
Area:658.904
Solvation:-10.5951
Coulombic:-63.0794
Bond Count [?]
All:34
Single:24
Double:10
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:441.452
H-Bond Donors:1
H-Bond Acceptors:8
XLogP:3.83
LogP (Chemaxon):0.36

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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