(5Z)-3-(5-chloro-1,3-benzothiazol-2-yl)-5-[(2-hydroxyphenyl)methylidene]-2-phenylimidazol-4-one

Formula:C23H14N3O2ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-3-(5-chloro-1,3-benzothiazol-2-yl)-5-[(2-hydroxyphenyl)methylidene]-2-phenylimidazol-4-one is not a drug-like molecule.

MolName(5Z)-3-(5-chloro-1,3-benzothiazol-2-yl)-5-[(2-hydroxyphenyl)methylidene]-2-phenylimidazol-4-one
MolecularFormulaC23H14N3O2ClS
SmilesOc1c(/C=C(/C2=O)\N=C(c3ccccc3)N2c2nc(cc(cc3)Cl)c3s2)cccc1
InChIInChI=1S/C23H14ClN3O2S/c24-16-10-11-20-17(13-16)26-23(30-20)27-21(14-6-2-1-3-7-14)25-18(22(27)29)12-15-8-4-5-9-19(15)28/h1-13,28H
InChIKDWOHPJKGRLQQHJ-UHFFFAOYSA-N
TotalMolweight431.902
Molweight431.902
MonoisotopicMass431.049524
CLogP5.2591
CLogS-6.673
H Acceptors5
H Donors1
TotalSurfaceArea306.08
Relative PSA0.23696
PolarSurfaceArea94.03
Druglikeness3.4135
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.46667
Fragments1
Non HAtoms30
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond3
Rings Closures5
Small Rings5
Aromatic Rings4
Aromatic Atoms21
Sp3Atoms1
Symmetricatoms2
Amides1
Aromatic Nitrogens1
BasicNitrogens1
StereoCon

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