Chemical ID: 4849311

CCN1C(=O)C(=Cc2ccc(cc2)C(=O)OC)SC1=Nc3cccc(c3)C(=O)O
Chemical ID:
4849311
Name [?]:
3-[3-ethyl-5-[(4-methoxycarbonylphenyl)methylene]-4-oxo-thiazolidin-2-ylidene]aminobenzoic acid
SMILES [?]:
CCN1C(=O)C(=Cc2ccc(cc2)C(=O)OC)SC1=Nc3cccc(c3)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H18N2O5S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:11.5871
Area:609.58
Solvation:-3.65234
Coulombic:-72.2596
Bond Count [?]
All:31
Single:20
Double:11
Rotors:6
Chiral:2
Rigid Segments:7
Chemical Properties
Molecular Weight:410.444
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:3.21
LogP (Chemaxon):3.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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