Chemical ID: 5371424

Cc1cc(=O)oc2c1ccc(c2)OC(=O)c3ccc(c(c3)[N+](=O)[O-])N4CCOCC4
Chemical ID:
5371424
Name [?]:
(4-methyl-2-oxo-chromen-7-yl) 4-morpholino-3-nitro-benzoate
SMILES [?]:
Cc1cc(=O)oc2c1ccc(c2)OC(=O)c3ccc(c(c3)[N+](=O)[O-])N4CCOCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H18N2O7
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:4.26816
Area:614.272
Solvation:-11.0886
Coulombic:-61.9158
Bond Count [?]
All:33
Single:23
Double:10
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:410.377
H-Bond Donors:0
H-Bond Acceptors:8
XLogP:3.21
LogP (Chemaxon):3.69

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