N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-2-carboxamide

Formula:C19H18N2O5S Mutagenic:none Tumorigenic:none Reproductive Effective:high N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-2-carboxamide is a drug-like molecule.

MolNameN-[(Z)-1-(1,3-benzodioxol-5-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-2-carboxamide
MolecularFormulaC19H18N2O5S
SmilesO=C(/C(/NC(c1cccs1)=O)=C/c(cc1)cc2c1OCO2)N1CCOCC1
InChIInChI=1S/C19H18N2O5S/c22-18(17-2-1-9-27-17)20-14(19(23)21-5-7-24-8-6-21)10-13-3-4-15-16(11-13)26-12-25-15/h1-4,9-11H,5-8,12H2,(H,20,22)
InChIKZFDQQQVNPCYDOM-UHFFFAOYSA-N
TotalMolweight386.427
Molweight386.427
MonoisotopicMass386.093643
CLogP2.9286
CLogS-3.792
H Acceptors7
H Donors1
TotalSurfaceArea282.73
Relative PSA0.32345
PolarSurfaceArea105.34
Druglikeness6.1667
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functions
Shape Index0.44444
Fragments1
Non HAtoms27
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond4
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms8
Symmetricatoms2
Amides2
StereoCon

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