Chemical ID: 5611251

c1ccc(cc1)C=CC=C2C(=O)OC(=N2)c3cccc(c3)[N+](=O)[O-]
Chemical ID:
5611251
Name [?]:
4-cinnamylidene-2-(3-nitrophenyl)-oxazol-5-one
SMILES [?]:
c1ccc(cc1)C=CC=C2C(=O)OC(=N2)c3cccc(c3)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H12N2O4
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:5.98966
Area:537.465
Solvation:-7.44697
Coulombic:-40.7464
Bond Count [?]
All:26
Single:15
Double:11
Rotors:4
Chiral:2
Rigid Segments:5
Chemical Properties
Molecular Weight:320.299
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:4.03
LogP (Chemaxon):4.14

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue