Chemical ID: 5558272

COc1cc(cc(c1OC)I)C=C2C(=O)NC(=Nc3ccc(cc3)F)S2
Chemical ID:
5558272
Name [?]:
2-(4-fluorophenyl)imino-5-[(3-iodo-4,5-dimethoxy-phenyl)methylene]thiazolidin-4-one
SMILES [?]:
COc1cc(cc(c1OC)I)C=C2C(=O)NC(=Nc3ccc(cc3)F)S2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H14FIN2O3S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:8.80303
Area:581.96
Solvation:-5.74597
Coulombic:-46.0693
Bond Count [?]
All:28
Single:19
Double:9
Rotors:4
Chiral:2
Rigid Segments:5
Chemical Properties
Molecular Weight:484.284
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.88
LogP (Chemaxon):4.98

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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