Chemical ID: 3988101

c1cc(ccc1CNC(=O)c2csc(n2)C3CCCNC3)Cl
Chemical ID:
3988101
Name [?]:
N-[(4-chlorophenyl)methyl]-2-(3-piperidyl)thiazole-4-carboxamide
SMILES [?]:
c1cc(ccc1CNC(=O)c2csc(n2)C3CCCNC3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H18ClN3OS
All Atoms:22
Heavy Atoms:22
Chiral Atoms:1
ZAP Information [?]
Total:11.8254
Area:550.401
Solvation:-1.93464
Coulombic:-39.0198
Bond Count [?]
All:24
Single:18
Double:6
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:335.852
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:2.33
LogP (Chemaxon):2.43

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