Chemical ID: 5145104

COc1cc(ccc1OCC(=O)OC)C=C2C(=O)NC(=Nc3ccc(cc3)F)S2
Chemical ID:
5145104
Name [?]:
methyl 2-[4-[[2-(4-fluorophenyl)imino-4-oxo-thiazolidin-5-ylidene]methyl]-2-methoxy-phenoxy]acetate
SMILES [?]:
COc1cc(ccc1OCC(=O)OC)C=C2C(=O)NC(=Nc3ccc(cc3)F)S2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H17FN2O5S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:7.93423
Area:630.284
Solvation:-7.82288
Coulombic:-63.9699
Bond Count [?]
All:31
Single:21
Double:10
Rotors:7
Chiral:2
Rigid Segments:7
Chemical Properties
Molecular Weight:416.424
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:2.52
LogP (Chemaxon):3.56

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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