Chemical ID: 6934428

CCC(C)C(=O)Nc1nc2ccccc2s1
Chemical ID:
6934428
Name [?]:
N-benzothiazol-2-yl-2-methyl-butanamide
SMILES [?]:
CCC(C)C(=O)Nc1nc2ccccc2s1
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H14N2OS
All Atoms:30
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:8.13626
Area:419.808
Solvation:-2.35894
Coulombic:-27.0191
Bond Count [?]
All:17
Single:12
Double:5
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:234.318
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.3
LogP (Chemaxon):3.99

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