[(Z)-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino] 3,4-dichlorobenzoate

Formula:C19H11N3O2Cl2S Mutagenic:high Tumorigenic:high Reproductive Effective:none [(Z)-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino] 3,4-dichlorobenzoate is not a drug-like molecule.

MolName[(Z)-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino] 3,4-dichlorobenzoate
MolecularFormulaC19H11N3O2Cl2S
SmilesO=C(c(cc1)cc(Cl)c1Cl)O/N=C\c1c(-c2ccccc2)nc2sccn12
InChIInChI=1S/C19H11Cl2N3O2S/c20-14-7-6-13(10-15(14)21)18(25)26-22-11-16-17(12-4-2-1-3-5-12)23-19-24(16)8-9-27-19/h1-11H
InChIKBWZCOAZDTCAAEZ-UHFFFAOYSA-N
TotalMolweight416.287
Molweight416.287
MonoisotopicMass414.994901
CLogP6.0075
CLogS-5.796
H Acceptors5
TotalSurfaceArea296.08
Relative PSA0.24936
PolarSurfaceArea84.2
Druglikeness-0.92907
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.55556
Fragments1
Non HAtoms27
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms20
Sp3Atoms1
Symmetricatoms2
Aromatic Nitrogens2
StereoCon

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