Chemical ID: 5561190

CC(C(=O)O)Oc1ccc(cc1)C=C2C(=O)NC(=Nc3cccc(c3)Cl)S2
Chemical ID:
5561190
Name [?]:
2-[4-[[2-(3-chlorophenyl)imino-4-oxo-thiazolidin-5-ylidene]methyl]phenoxy]propanoic acid
SMILES [?]:
CC(C(=O)O)Oc1ccc(cc1)C=C2C(=O)NC(=Nc3cccc(c3)Cl)S2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H15ClN2O4S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:1
ZAP Information [?]
Total:11.0498
Area:617.07
Solvation:-4.37693
Coulombic:-64.1133
Bond Count [?]
All:29
Single:19
Double:10
Rotors:5
Chiral:2
Rigid Segments:5
Chemical Properties
Molecular Weight:402.852
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:3.54
LogP (Chemaxon):4.22

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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