(5Z)-5-benzylidene-2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-4-one

Formula:C20H18N3OFS Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-benzylidene-2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-4-one is a drug-like molecule.

MolName	(5Z)-5-benzylidene-2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-4-one
MolecularFormula	C20H18N3OFS
Smiles	O=C1N=C(N(CC2)CCN2c(cc2)ccc2F)S/C1=C\c1ccccc1
InChI	InChI=1S/C20H18FN3OS/c21-16-6-8-17(9-7-16)23-10-12-24(13-11-23)20-22-19(25)18(26-20)14-15-4-2-1-3-5-15/h1-9,14H,10-13H2
InChIK	MRNGOLXFPJLTEC-UHFFFAOYSA-N
TotalMolweight	367.447
Molweight	367.447
MonoisotopicMass	367.11546
CLogP	3.2904
CLogS	-4.571
H Acceptors	4
TotalSurfaceArea	270.93
Relative PSA	0.18138
PolarSurfaceArea	61.21
Druglikeness	4.9558
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.65385
Fragments	1
Non HAtoms	26
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	2
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	6
Amines	1
Aromatic Amines	1
BasicNitrogens	1
StereoCon

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