Chemical ID: 6404940

CN1C(C(=C(c2ccc(cc2)Cl)O)C(=O)C1=O)c3ccccc3F
Chemical ID:
6404940
Name [?]:
4-[(4-chlorophenyl)-hydroxy-methylene]-5-(2-fluorophenyl)-1-methyl-pyrrolidine-2,3-dione
SMILES [?]:
CN1C(C(=C(c2ccc(cc2)Cl)O)C(=O)C1=O)c3ccccc3F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H13ClFNO3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:1
ZAP Information [?]
Total:8.55727
Area:490.208
Solvation:-3.69793
Coulombic:-49.2407
Bond Count [?]
All:26
Single:17
Double:9
Rotors:2
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:345.752
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.34
LogP (Chemaxon):2.43

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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