Chemical ID: 4378160

COc1ccc(cc1)S(=O)(=O)Oc2ccc(cc2)C=C3C(=O)NC(=O)NC3=O
Chemical ID:
4378160
Name [?]:
5-[[4-(4-methoxyphenyl)sulfonyloxyphenyl]methylene]hexahydropyrimidine-2,4,6-trione
SMILES [?]:
COc1ccc(cc1)S(=O)(=O)Oc2ccc(cc2)C=C3C(=O)NC(=O)NC3=O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H14N2O7S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:8.62728
Area:562.75
Solvation:-5.44147
Coulombic:-66.6657
Bond Count [?]
All:30
Single:18
Double:12
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:402.379
H-Bond Donors:2
H-Bond Acceptors:9
XLogP:1.57
LogP (Chemaxon):1.65

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