Chemical ID: 4416435

COc1cccc(c1OC)C=C2C(=O)N=C(S2)Nc3ccc(c(c3)C(=O)O)Cl
Chemical ID:
4416435
Name [?]:
2-chloro-5-[5-[(2,3-dimethoxyphenyl)methylene]-4-oxo-thiazol-2-yl]amino-benzoic acid
SMILES [?]:
COc1cccc(c1OC)C=C2C(=O)N=C(S2)Nc3ccc(c(c3)C(=O)O)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H15ClN2O5S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:9.81514
Area:610.685
Solvation:-5.45199
Coulombic:-70.796
Bond Count [?]
All:30
Single:20
Double:10
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:418.852
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:3.15
LogP (Chemaxon):3.73

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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