Chemical ID: 6477482

CC1(OC(=O)C(=CN2CCN(CC2)c3ccc(cn3)C(F)(F)F)C(=O)O1)C
Chemical ID:
6477482
Name [?]:
2,2-dimethyl-5-[[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]methylene]-1,3-dioxane-4,6-dione
SMILES [?]:
CC1(OC(=O)C(=CN2CCN(CC2)c3ccc(cn3)C(F)(F)F)C(=O)O1)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H18F3N3O4
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:9.22639
Area:545.291
Solvation:-4.40588
Coulombic:-73.3077
Bond Count [?]
All:29
Single:23
Double:6
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:385.338
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:3.68
LogP (Chemaxon):2.83

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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