Chemical ID: 5800356

CCOc1cc(ccc1O)C=NNC(=O)c2c(n(nn2)c3c(non3)N)CN4CCCCC4
Chemical ID:
5800356
Name [?]:
1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(3-ethoxy-4-hydroxy-phenyl)methyleneamino]-5-(1-piperidylmethyl)triazole-4-carboxamide
SMILES [?]:
CCOc1cc(ccc1O)C=NNC(=O)c2c(n(nn2)c3c(non3)N)CN4CCCCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H25N9O4
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:11.0492
Area:676.275
Solvation:-5.8577
Coulombic:-73.7515
Bond Count [?]
All:36
Single:27
Double:9
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:455.471
H-Bond Donors:4
H-Bond Acceptors:7
XLogP:2.93
LogP (Chemaxon):1.58

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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