Chemical ID: 5300453

CN(Cc1c(nnn1c2c(non2)N)C(=O)NN=Cc3ccc(cc3)C(F)(F)F)C4CCCCC4
Chemical ID:
5300453
Name [?]:
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(cyclohexyl-methyl-amino)methyl]-N-[[4-(trifluoromethyl)phenyl]methyleneamino]triazole-4-carboxamide
SMILES [?]:
CN(Cc1c(nnn1c2c(non2)N)C(=O)NN=Cc3ccc(cc3)C(F)(F)F)C4CCCCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H24F3N9O2
All Atoms:35
Heavy Atoms:35
Chiral Atoms:1
ZAP Information [?]
Total:12.6805
Area:670.088
Solvation:-4.07173
Coulombic:-70.8934
Bond Count [?]
All:38
Single:29
Double:9
Rotors:9
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:491.47
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:4.88
LogP (Chemaxon):3.52

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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