Chemical ID: 4351064

c1ccc(c(c1)NC2=NC(=O)C(=Cc3ccc(cc3)Br)S2)O
Chemical ID:
4351064
Name [?]:
5-[(4-bromophenyl)methylene]-2-(2-hydroxyphenyl)amino-thiazol-4-one
SMILES [?]:
c1ccc(c(c1)NC2=NC(=O)C(=Cc3ccc(cc3)Br)S2)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H11BrN2O2S
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.2878
Area:510.415
Solvation:-2.47258
Coulombic:-47.0119
Bond Count [?]
All:24
Single:15
Double:9
Rotors:3
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:375.241
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:4.18
LogP (Chemaxon):4.71

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