Chemical ID: 5548268

CCN1C(=O)C(=Cc2cccc(c2)Br)SC1=Nc3cccc(c3)C(=O)O
Chemical ID:
5548268
Name [?]:
3-[5-[(3-bromophenyl)methylene]-3-ethyl-4-oxo-thiazolidin-2-ylidene]aminobenzoic acid
SMILES [?]:
CCN1C(=O)C(=Cc2cccc(c2)Br)SC1=Nc3cccc(c3)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H15BrN2O3S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.3402
Area:561.223
Solvation:-2.69035
Coulombic:-53.1364
Bond Count [?]
All:28
Single:18
Double:10
Rotors:4
Chiral:2
Rigid Segments:5
Chemical Properties
Molecular Weight:431.304
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.07
LogP (Chemaxon):5.02

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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