Chemical ID: 5301441

COc1cc(ccc1O)C=C2C(=O)NC(=Nc3ccc(c(c3)C(F)(F)F)Cl)S2
Chemical ID:
5301441
Name [?]:
2-[4-chloro-3-(trifluoromethyl)phenyl]imino-5-[(4-hydroxy-3-methoxy-phenyl)methylene]thiazolidin-4-one
SMILES [?]:
COc1cc(ccc1O)C=C2C(=O)NC(=Nc3ccc(c(c3)C(F)(F)F)Cl)S2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H12ClF3N2O3S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:9.07228
Area:586.964
Solvation:-5.60183
Coulombic:-69.0187
Bond Count [?]
All:30
Single:21
Double:9
Rotors:4
Chiral:2
Rigid Segments:5
Chemical Properties
Molecular Weight:428.813
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:4.15
LogP (Chemaxon):5.22

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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