Chemical ID: 5659538

c1ccc(cc1)CN2C(C(=C(c3ccc(cc3)Cl)O)C(=O)C2=O)c4ccccc4F
Chemical ID:
5659538
Name [?]:
1-benzyl-4-[(4-chlorophenyl)-hydroxy-methylene]-5-(2-fluorophenyl)-pyrrolidine-2,3-dione
SMILES [?]:
c1ccc(cc1)CN2C(C(=C(c3ccc(cc3)Cl)O)C(=O)C2=O)c4ccccc4F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H17ClFNO3
All Atoms:30
Heavy Atoms:30
Chiral Atoms:1
ZAP Information [?]
Total:10.0077
Area:552.924
Solvation:-3.81537
Coulombic:-51.2574
Bond Count [?]
All:33
Single:21
Double:12
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:421.848
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:5.05
LogP (Chemaxon):4.21

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue