Chemical ID: 4335498

Cc1ccc(cc1Cl)NC2=NC(=O)C(=Cc3ccc(c(c3)Br)O)S2
Chemical ID:
4335498
Name [?]:
5-[(3-bromo-4-hydroxy-phenyl)methylene]-2-(3-chloro-4-methyl-phenyl)amino-thiazol-4-one
SMILES [?]:
Cc1ccc(cc1Cl)NC2=NC(=O)C(=Cc3ccc(c(c3)Br)O)S2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H12BrClN2O2S
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:11.2157
Area:559.378
Solvation:-2.76872
Coulombic:-46.0862
Bond Count [?]
All:26
Single:17
Double:9
Rotors:3
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:423.712
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:4.59
LogP (Chemaxon):5.7

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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