(NE)-N-[(2E)-2-[(3-nitrophenyl)methylidene]-1-azabicyclo[2.2.2]octan-3-ylidene]hydroxylamine

Formula:C14H15N3O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (NE)-N-[(2E)-2-[(3-nitrophenyl)methylidene]-1-azabicyclo[2.2.2]octan-3-ylidene]hydroxylamine is a drug-like molecule.

MolName	(NE)-N-[(2E)-2-[(3-nitrophenyl)methylidene]-1-azabicyclo[2.2.2]octan-3-ylidene]hydroxylamine
MolecularFormula	C14H15N3O3
Smiles	[O-][N+](c1cc(/C=C2/N(CC3)CCC3/C2=N\O)ccc1)=O
InChI	InChI=1S/C14H15N3O3/c18-15-14-11-4-6-16(7-5-11)13(14)9-10-2-1-3-12(8-10)17(19)20/h1-3,8-9,11,18H,4-7H2
InChIK	ZJWLLSOPNNQALB-UHFFFAOYSA-N
TotalMolweight	273.291
Molweight	273.291
MonoisotopicMass	273.111342
CLogP	1.1786
CLogS	-3.504
H Acceptors	6
H Donors	1
TotalSurfaceArea	201.8
Relative PSA	0.29029
PolarSurfaceArea	81.65
Druglikeness	-0.3897
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.5
Fragments	1
Non HAtoms	20
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	2
Rings Closures	3
Small Rings	4
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	8
Symmetricatoms	2
BasicNitrogens	1
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - (NE)-N-[(2E)-2-[(3-nitrophenyl)methylidene]-1-azabicyclo[2.2.2]octan-3-ylidene]hydroxylamine | 2 - (NE)-N-[(2E)-2-[(3-nitrophenyl)methylidene]-1-azabicyclo[2.2.2]octan-3-ylidene]hydroxylamine

Request More Details | (NE)-N-[(2E)-2-[(3-nitrophenyl)methylidene]-1-azabicyclo[2.2.2]octan-3-ylidene]hydroxylamine

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments