Chemical ID: 5994988

c1ccc(cc1)c2nc(on2)C3CCCCN3C(=O)C=Cc4ccc(cc4)[N+](=O)[O-]
Chemical ID:
5994988
Name [?]:
3-(4-nitrophenyl)-1-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-piperidyl]-prop-2-en-1-one
SMILES [?]:
c1ccc(cc1)c2nc(on2)C3CCCCN3C(=O)C=Cc4ccc(cc4)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H20N4O4
All Atoms:30
Heavy Atoms:30
Chiral Atoms:1
ZAP Information [?]
Total:5.84871
Area:557.268
Solvation:-8.08299
Coulombic:-43.1924
Bond Count [?]
All:33
Single:22
Double:11
Rotors:6
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:404.419
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:4.43
LogP (Chemaxon):4.43

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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