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C19H18N2O3F2 (E)-1-[2-[(2,5-difluorophenoxy)methyl]morpholin-4-yl]-3-pyridin-2-ylprop-2-en-1-one | Chemryt

(E)-1-[2-[(2,5-difluorophenoxy)methyl]morpholin-4-yl]-3-pyridin-2-ylprop-2-en-1-one

Molecular Formula : C19H18N2O3F2 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : |

MolName : (E)-1-[2-[(2,5-difluorophenoxy)methyl]morpholin-4-yl]-3-pyridin-2-ylprop-2-en-1-one

MolecularFormula : C19H18N2O3F2

Smiles : O=C(/C=C/c1ncccc1)N1CC(COc(cc(cc2)F)c2F)OCC1

InChI : InChI=1S/C19H18F2N2O3/c20-14-4-6-17(21)18(11-14)26-13-16-12-23(9-10-25-16)19(24)7-5-15-3-1-2-8-22-15/h1-8,11,16H,9-10,12-13H2/t16-/m1/s1

InChIK : CNPZSENMEKNIAR-MRXNPFEDSA-N

TotalMolweight : 360.359

Molweight : 360.359

MonoisotopicMass : 360.128549

CLogP : 2.2612

CLogS : -2.881

H Acceptors : 5

TotalSurfaceArea : 273.07

Relative PSA : 0.17417

PolarSurfaceArea : 51.66

Druglikeness : 1.6683

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Shape Index : 0.61538

Fragments : 1

Non HAtoms : 26

NonCHAtoms : 7

Electronegative Atoms : 7

StereoCenters : 1

Rotatable Bond : 5

Rings Closures : 3

Small Rings : 3

Aromatic Rings : 2

Aromatic Atoms : 12

Sp3Atoms : 7

Amides : 1

Aromatic Nitrogens : 1

StereoCon : racemate

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