Chemical ID: 4540155

COc1ccc(cc1)N=C2NC(=O)C(=Cc3ccc(cc3)OCC(=O)OC)S2
Chemical ID:
4540155
Name [?]:
methyl 2-[4-[[2-(4-methoxyphenyl)imino-4-oxo-thiazolidin-5-ylidene]methyl]phenoxy]acetate
SMILES [?]:
COc1ccc(cc1)N=C2NC(=O)C(=Cc3ccc(cc3)OCC(=O)OC)S2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H18N2O5S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:9.73115
Area:627.217
Solvation:-5.94927
Coulombic:-61.5026
Bond Count [?]
All:30
Single:20
Double:10
Rotors:7
Chiral:2
Rigid Segments:7
Chemical Properties
Molecular Weight:398.433
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:2.62
LogP (Chemaxon):3.42

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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