Chemical ID: 4852666

CCOc1cc(ccc1O)C=C2C(=O)N(C(=S)S2)c3ccc4c(c3)OCO4
Chemical ID:
4852666
Name [?]:
3-benzo[1,3]dioxol-5-yl-5-[(3-ethoxy-4-hydroxy-phenyl)methylene]-2-thioxo-thiazolidin-4-one
SMILES [?]:
CCOc1cc(ccc1O)C=C2C(=O)N(C(=S)S2)c3ccc4c(c3)OCO4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H15NO5S2
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:8.96575
Area:588.815
Solvation:-5.75462
Coulombic:-57.5765
Bond Count [?]
All:30
Single:21
Double:9
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:401.458
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:3.08
LogP (Chemaxon):3.98

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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