N-[(Z)-[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylideneamino]-2,2-diphenylacetamide

Formula:C25H18N3O4Cl Mutagenic:high Tumorigenic:high Reproductive Effective:none N-[(Z)-[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylideneamino]-2,2-diphenylacetamide is not a drug-like molecule.

MolName	N-[(Z)-[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylideneamino]-2,2-diphenylacetamide
MolecularFormula	C25H18N3O4Cl
Smiles	[O-][N+](c(cc1)cc(-c2ccc(/C=N\NC(C(c3ccccc3)c3ccccc3)=O)o2)c1Cl)=O
InChI	InChI=1S/C25H18ClN3O4/c26-22-13-11-19(29(31)32)15-21(22)23-14-12-20(33-23)16-27-28-25(30)24(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-16,24H,(H,28,30)
InChIK	SULLVWIKYVBQOJ-UHFFFAOYSA-N
TotalMolweight	459.888
Molweight	459.888
MonoisotopicMass	459.098584
CLogP	5.3506
CLogS	-7.491
H Acceptors	7
H Donors	1
TotalSurfaceArea	347.79
Relative PSA	0.23158
PolarSurfaceArea	100.42
Druglikeness	2.0496
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.51515
Fragments	1
Non HAtoms	33
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	2
Symmetricatoms	8
AcidicOxygens	1
StereoCon

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