(4E)-2-(4-chlorophenyl)-4-[(2-morpholin-4-ylquinolin-3-yl)methylidene]-1,3-oxazol-5-one

Formula:C23H18N3O3Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none (4E)-2-(4-chlorophenyl)-4-[(2-morpholin-4-ylquinolin-3-yl)methylidene]-1,3-oxazol-5-one is a drug-like molecule.

MolName(4E)-2-(4-chlorophenyl)-4-[(2-morpholin-4-ylquinolin-3-yl)methylidene]-1,3-oxazol-5-one
MolecularFormulaC23H18N3O3Cl
SmilesO=C1OC(c(cc2)ccc2Cl)=N/C1=C/c1cc2ccccc2nc1N1CCOCC1
InChIInChI=1S/C23H18ClN3O3/c24-18-7-5-15(6-8-18)22-26-20(23(28)30-22)14-17-13-16-3-1-2-4-19(16)25-21(17)27-9-11-29-12-10-27/h1-8,13-14H,9-12H2
InChIKRJSQOXFPPOJZHH-UHFFFAOYSA-N
TotalMolweight419.867
Molweight419.867
MonoisotopicMass419.103669
CLogP3.5342
CLogS-5.989
H Acceptors6
TotalSurfaceArea305.57
Relative PSA0.19331
PolarSurfaceArea64.02
Druglikeness2.3163
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.5
Fragments1
Non HAtoms30
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond3
Rings Closures5
Small Rings5
Aromatic Rings3
Aromatic Atoms16
Sp3Atoms6
Symmetricatoms4
Aromatic Nitrogens1
BasicNitrogens1
StereoCon

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