2-[2-chloro-4-[(Z)-2-nitroethenyl]phenoxy]-N-(2-fluorophenyl)acetamide

Formula:C16H12N2O4ClF Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[2-chloro-4-[(Z)-2-nitroethenyl]phenoxy]-N-(2-fluorophenyl)acetamide is a drug-like molecule.

MolName2-[2-chloro-4-[(Z)-2-nitroethenyl]phenoxy]-N-(2-fluorophenyl)acetamide
MolecularFormulaC16H12N2O4ClF
Smiles[O-][N+](/C=C\c(cc1)cc(Cl)c1OCC(Nc(cccc1)c1F)=O)=O
InChIInChI=1S/C16H12ClFN2O4/c17-12-9-11(7-8-20(22)23)5-6-15(12)24-10-16(21)19-14-4-2-1-3-13(14)18/h1-9H,10H2,(H,19,21)
InChIKVEODKYINWYEFJJ-UHFFFAOYSA-N
TotalMolweight350.732
Molweight350.732
MonoisotopicMass350.046963
CLogP2.199
CLogS-4.968
H Acceptors6
H Donors1
TotalSurfaceArea257.93
Relative PSA0.2517
PolarSurfaceArea84.15
Druglikeness-5.4877
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.66667
Fragments1
Non HAtoms24
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond6
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms3
Amides1
AcidicOxygens1
StereoCon

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