Chemical ID: 5139711

COc1ccc(c(c1)C=C2C(=O)NC(=Nc3ccccc3F)S2)OC
Chemical ID:
5139711
Name [?]:
5-[(2,5-dimethoxyphenyl)methylene]-2-(2-fluorophenyl)imino-thiazolidin-4-one
SMILES [?]:
COc1ccc(c(c1)C=C2C(=O)NC(=Nc3ccccc3F)S2)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H15FN2O3S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:8.13001
Area:546.387
Solvation:-5.52966
Coulombic:-46.5407
Bond Count [?]
All:27
Single:18
Double:9
Rotors:4
Chiral:2
Rigid Segments:5
Chemical Properties
Molecular Weight:358.388
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.08
LogP (Chemaxon):3.99

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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