N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]benzamide
Molecular Formula : C18H18N2O4 | Mutagenic : high | Tumorigenic : none | Reproductive Effective : none |N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.
MolName : N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]benzamide |
MolecularFormula : C18H18N2O4 |
Smiles : O=C(/C(/NC(c1ccccc1)=O)=C/c1ccco1)N1CCOCC1 |
InChI : InChI=1S/C18H18N2O4/c21-17(14-5-2-1-3-6-14)19-16(13-15-7-4-10-24-15)18(22)20-8-11-23-12-9-20/h1-7,10,13H,8-9,11-12H2,(H,19,21) |
InChIK : QXVAJZPBNHIOOY-UHFFFAOYSA-N |
TotalMolweight : 326.351 |
Molweight : 326.351 |
MonoisotopicMass : 326.126658 |
CLogP : 2.1393 |
CLogS : -2.753 |
H Acceptors : 6 |
H Donors : 1 |
TotalSurfaceArea : 256.22 |
Relative PSA : 0.25447 |
PolarSurfaceArea : 71.78 |
Druglikeness : 4.5997 |
Mutagenic : high |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : |
Shape Index : 0.5 |
Fragments : 1 |
Non HAtoms : 24 |
NonCHAtoms : 6 |
Electronegative Atoms : 6 |
Rotatable Bond : 4 |
Rings Closures : 3 |
Small Rings : 3 |
Aromatic Rings : 2 |
Aromatic Atoms : 11 |
Sp3Atoms : 5 |
Symmetricatoms : 4 |
Amides : 2 |
StereoCon : |