Chemical ID: 6519272

CC1=C(C(=O)N(C(=O)C1=CNc2ccc(cc2)F)Cc3ccccc3)C#N
Chemical ID:
6519272
Name [?]:
1-benzyl-5-[(4-fluorophenyl)aminomethylene]-4-methyl-2,6-dioxo-pyridine-3-carbonitrile
SMILES [?]:
CC1=C(C(=O)N(C(=O)C1=CNc2ccc(cc2)F)Cc3ccccc3)C#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H16FN3O2
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:10.0751
Area:559.533
Solvation:-3.91321
Coulombic:-45.3666
Bond Count [?]
All:29
Single:18
Double:10
Rotors:4
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:361.369
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.05
LogP (Chemaxon):3.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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