Chemical ID: 5940347

C=CCNc1nc(cs1)c2ccc(cc2)NC(=O)c3cccc(c3)Cl
Chemical ID:
5940347
Name [?]:
N-[4-(2-allylaminothiazol-4-yl)phenyl]-3-chloro-benzamide
SMILES [?]:
C=CCNc1nc(cs1)c2ccc(cc2)NC(=O)c3cccc(c3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H16ClN3OS
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:12.6278
Area:607.111
Solvation:-2.54994
Coulombic:-42.9034
Bond Count [?]
All:27
Single:17
Double:10
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:369.869
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:4.71
LogP (Chemaxon):5.28

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