Chemical ID: 5618984

CCN1CCN(CC1)c2nc3ccccc3s2
Chemical ID:
5618984
Name [?]:
2-(4-ethylpiperazin-1-yl)benzothiazole
SMILES [?]:
CCN1CCN(CC1)c2nc3ccccc3s2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H17N3S
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:9.01879
Area:423.414
Solvation:-1.56656
Coulombic:-19.4667
Bond Count [?]
All:19
Single:15
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:247.36
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.21
LogP (Chemaxon):3.49

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