5-phenyl-3-[1-[(E)-3-thiophen-2-ylprop-2-enoyl]piperidin-4-yl]-1,3-oxazolidin-2-one

Formula:C21H22N2O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 5-phenyl-3-[1-[(E)-3-thiophen-2-ylprop-2-enoyl]piperidin-4-yl]-1,3-oxazolidin-2-one is a drug-like molecule.

MolName	5-phenyl-3-[1-[(E)-3-thiophen-2-ylprop-2-enoyl]piperidin-4-yl]-1,3-oxazolidin-2-one
MolecularFormula	C21H22N2O3S
Smiles	O=C(/C=C/c1cccs1)N(CC1)CCC1N(CC(c1ccccc1)O1)C1=O
InChI	InChI=1S/C21H22N2O3S/c24-20(9-8-18-7-4-14-27-18)22-12-10-17(11-13-22)23-15-19(26-21(23)25)16-5-2-1-3-6-16/h1-9,14,17,19H,10-13,15H2/t19-/m1/s1
InChIK	XKBDMIRUVSNXMA-LJQANCHMSA-N
TotalMolweight	382.483
Molweight	382.483
MonoisotopicMass	382.135113
CLogP	3.5605
CLogS	-3.663
H Acceptors	5
TotalSurfaceArea	288.36
Relative PSA	0.22035
PolarSurfaceArea	78.09
Druglikeness	1.0418
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.62963
Fragments	1
Non HAtoms	27
NonCHAtoms	6
Electronegative Atoms	6
StereoCenters	1
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	8
Symmetricatoms	4
Amides	2
StereoCon	racemate

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