Chemical ID: 4422181

COc1ccccc1N2C(=O)C(=Cc3ccc(c(c3)Br)OC)SC2=O
Chemical ID:
4422181
Name [?]:
5-[(3-bromo-4-methoxy-phenyl)methylene]-3-(2-methoxyphenyl)-thiazolidine-2,4-dione
SMILES [?]:
COc1ccccc1N2C(=O)C(=Cc3ccc(c(c3)Br)OC)SC2=O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H14BrNO4S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:8.78194
Area:550.71
Solvation:-4.9858
Coulombic:-43.0791
Bond Count [?]
All:27
Single:18
Double:9
Rotors:4
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:420.278
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:3.77
LogP (Chemaxon):4.04

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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