Chemical ID: 4102097

Cc1ccccc1N2C(=O)C(=Cc3ccc(c(c3)Br)F)SC2=S
Chemical ID:
4102097
Name [?]:
5-[(3-bromo-4-fluoro-phenyl)methylene]-3-(o-tolyl)-2-thioxo-thiazolidin-4-one
SMILES [?]:
Cc1ccccc1N2C(=O)C(=Cc3ccc(c(c3)Br)F)SC2=S
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H11BrFNOS2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.5976
Area:519.574
Solvation:-2.39179
Coulombic:-24.057
Bond Count [?]
All:25
Single:16
Double:9
Rotors:2
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:408.31
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.58
LogP (Chemaxon):5.89

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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