Chemical ID: 4756529

c1cc(ccc1C(=O)CNC(=O)CCC(=O)O)F
Chemical ID:
4756529
Name [?]:
4-[2-(4-fluorophenyl)-2-oxo-ethyl]amino-4-oxo-butanoic acid
SMILES [?]:
c1cc(ccc1C(=O)CNC(=O)CCC(=O)O)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H12FNO4
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:6.73162
Area:452.687
Solvation:-4.58555
Coulombic:-56.8365
Bond Count [?]
All:18
Single:12
Double:6
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:253.226
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:0.57
LogP (Chemaxon):0.21

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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