Chemical ID: 4400496

c1ccc(c(c1)NC2=NC(=O)C(=Cc3cc(ccc3O)Br)S2)Cl
Chemical ID:
4400496
Name [?]:
5-[(5-bromo-2-hydroxy-phenyl)methylene]-2-(2-chlorophenyl)amino-thiazol-4-one
SMILES [?]:
c1ccc(c(c1)NC2=NC(=O)C(=Cc3cc(ccc3O)Br)S2)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H10BrClN2O2S
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:11.0524
Area:536.951
Solvation:-2.37139
Coulombic:-46.8963
Bond Count [?]
All:25
Single:16
Double:9
Rotors:3
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:409.686
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:4.37
LogP (Chemaxon):5.23

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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