Chemical ID: 5569909

CCOc1ccc(cc1)c2c(sc(n2)NC(=O)COc3ccccc3C#N)C
Chemical ID:
5569909
Name [?]:
2-(2-cyanophenoxy)-N-[4-(4-ethoxyphenyl)-5-methyl-thiazol-2-yl]-acetamide
SMILES [?]:
CCOc1ccc(cc1)c2c(sc(n2)NC(=O)COc3ccccc3C#N)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H19N3O3S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:9.47492
Area:637.287
Solvation:-6.45727
Coulombic:-44.7316
Bond Count [?]
All:30
Single:20
Double:9
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:393.46
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.42
LogP (Chemaxon):4.12

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