5-(phenoxymethyl)-3-[1-[(E)-3-(2,3,4-trifluorophenyl)prop-2-enoyl]piperidin-4-yl]-1,3-oxazolidin-2-one

Formula:C24H23N2O4F3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 5-(phenoxymethyl)-3-[1-[(E)-3-(2,3,4-trifluorophenyl)prop-2-enoyl]piperidin-4-yl]-1,3-oxazolidin-2-one is a drug-like molecule.

MolName5-(phenoxymethyl)-3-[1-[(E)-3-(2,3,4-trifluorophenyl)prop-2-enoyl]piperidin-4-yl]-1,3-oxazolidin-2-one
MolecularFormulaC24H23N2O4F3
SmilesO=C(/C=C/c(c(F)c1F)ccc1F)N(CC1)CCC1N(CC(COc1ccccc1)O1)C1=O
InChIInChI=1S/C24H23F3N2O4/c25-20-8-6-16(22(26)23(20)27)7-9-21(30)28-12-10-17(11-13-28)29-14-19(33-24(29)31)15-32-18-4-2-1-3-5-18/h1-9,17,19H,10-15H2/t19-/m0/s1
InChIKHKWCNNZKRAHZDR-IBGZPJMESA-N
TotalMolweight460.451
Molweight460.451
MonoisotopicMass460.160992
CLogP3.8235
CLogS-4.829
H Acceptors6
TotalSurfaceArea335.23
Relative PSA0.15864
PolarSurfaceArea59.08
Druglikeness-1.8887
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionspolyhalo aromatic ring
Shape Index0.63636
Fragments1
Non HAtoms33
NonCHAtoms9
Electronegative Atoms9
StereoCenters1
Rotatable Bond6
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms10
Symmetricatoms4
Amides2
StereoConracemate

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