Chemical ID: 5308016

CN(Cc1c(nnn1c2c(non2)N)C(=O)NN=Cc3cccc(c3OC)OC)C4CCCCC4
Chemical ID:
5308016
Name [?]:
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(cyclohexyl-methyl-amino)methyl]-N-[(2,3-dimethoxyphenyl)methyleneamino]triazole-4-carboxamide
SMILES [?]:
CN(Cc1c(nnn1c2c(non2)N)C(=O)NN=Cc3cccc(c3OC)OC)C4CCCCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H29N9O4
All Atoms:35
Heavy Atoms:35
Chiral Atoms:1
ZAP Information [?]
Total:11.3992
Area:694.114
Solvation:-5.95368
Coulombic:-66.2692
Bond Count [?]
All:38
Single:29
Double:9
Rotors:10
Chiral:1
Rigid Segments:9
Chemical Properties
Molecular Weight:483.524
H-Bond Donors:3
H-Bond Acceptors:7
XLogP:3.52
LogP (Chemaxon):2.13

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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