Chemical ID: 5994997

COc1cccc(c1)c2nc(on2)C3CCCN(C3)C(=O)C=Cc4ccc(cc4)[N+](=O)[O-]
Chemical ID:
5994997
Name [?]:
1-[3-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-piperidyl]-3-(4-nitrophenyl)-prop-2-en-1-one
SMILES [?]:
COc1cccc(c1)c2nc(on2)C3CCCN(C3)C(=O)C=Cc4ccc(cc4)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H22N4O5
All Atoms:32
Heavy Atoms:32
Chiral Atoms:1
ZAP Information [?]
Total:7.68761
Area:674.705
Solvation:-9.18
Coulombic:-49.0218
Bond Count [?]
All:35
Single:24
Double:11
Rotors:7
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:434.445
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:3.91
LogP (Chemaxon):3.91

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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