Chemical ID: 5987954

CCCCC(CC)C(=O)N1CCCC(C1)c2nc(no2)c3ccc(cc3)Br
Chemical ID:
5987954
Name [?]:
1-[3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-1-piperidyl]-2-ethyl-hexan-1-one
SMILES [?]:
CCCCC(CC)C(=O)N1CCCC(C1)c2nc(no2)c3ccc(cc3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H28BrN3O2
All Atoms:27
Heavy Atoms:27
Chiral Atoms:2
ZAP Information [?]
Total:13.4533
Area:631.868
Solvation:-2.34344
Coulombic:-30.4807
Bond Count [?]
All:29
Single:23
Double:6
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:434.37
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:5.85
LogP (Chemaxon):5.46

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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