Chemical ID: 5803003

c1cc(ccc1N2C(=O)C(=Cc3ccc(o3)c4cc(ccc4Cl)[N+](=O)[O-])SC2=O)Cl
Chemical ID:
5803003
Name [?]:
5-[[5-(2-chloro-5-nitro-phenyl)-2-furyl]methylene]-3-(4-chlorophenyl)-thiazolidine-2,4-dione
SMILES [?]:
c1cc(ccc1N2C(=O)C(=Cc3ccc(o3)c4cc(ccc4Cl)[N+](=O)[O-])SC2=O)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H10Cl2N2O5S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:6.76518
Area:639.336
Solvation:-9.21822
Coulombic:-45.0638
Bond Count [?]
All:33
Single:21
Double:12
Rotors:4
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:461.275
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:4.81
LogP (Chemaxon):5.14

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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