N-[(E)-1-(4-nitrophenyl)-3-oxo-3-(2-phenylethylamino)prop-1-en-2-yl]furan-2-carboxamide

Formula:C22H19N3O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(E)-1-(4-nitrophenyl)-3-oxo-3-(2-phenylethylamino)prop-1-en-2-yl]furan-2-carboxamide is a drug-like molecule.

MolName	N-[(E)-1-(4-nitrophenyl)-3-oxo-3-(2-phenylethylamino)prop-1-en-2-yl]furan-2-carboxamide
MolecularFormula	C22H19N3O5
Smiles	[O-][N+](c1ccc(/C=C(\C(NCCc2ccccc2)=O)/NC(c2ccco2)=O)cc1)=O
InChI	InChI=1S/C22H19N3O5/c26-21(23-13-12-16-5-2-1-3-6-16)19(24-22(27)20-7-4-14-30-20)15-17-8-10-18(11-9-17)25(28)29/h1-11,14-15H,12-13H2,(H,23,26)(H,24,27)
InChIK	NEYQQNXLNGBTOU-UHFFFAOYSA-N
TotalMolweight	405.409
Molweight	405.409
MonoisotopicMass	405.132472
CLogP	2.8304
CLogS	-4.943
H Acceptors	8
H Donors	2
TotalSurfaceArea	316.79
Relative PSA	0.29524
PolarSurfaceArea	117.16
Druglikeness	-1.5596
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	4
Amides	2
AcidicOxygens	1
StereoCon

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