Chemical ID: 5561261

Cc1ccc(cc1N=C2NC(=O)C(=Cc3ccc(c(c3)OC)OC(C)C(=O)O)S2)Cl
Chemical ID:
5561261
Name [?]:
2-[4-[[2-(5-chloro-2-methyl-phenyl)imino-4-oxo-thiazolidin-5-ylidene]methyl]-2-methoxy-phenoxy]propanoic acid
SMILES [?]:
Cc1ccc(cc1N=C2NC(=O)C(=Cc3ccc(c(c3)OC)OC(C)C(=O)O)S2)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H19ClN2O5S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:1
ZAP Information [?]
Total:10.1337
Area:665.331
Solvation:-6.49961
Coulombic:-69.9109
Bond Count [?]
All:32
Single:22
Double:10
Rotors:6
Chiral:2
Rigid Segments:6
Chemical Properties
Molecular Weight:446.905
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:3.41
LogP (Chemaxon):4.34

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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