(E)-3-(3-nitrophenyl)-1-[4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]piperazin-1-yl]prop-2-en-1-one

Formula:C22H20N4O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(3-nitrophenyl)-1-[4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]piperazin-1-yl]prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(3-nitrophenyl)-1-[4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]piperazin-1-yl]prop-2-en-1-one
MolecularFormula	C22H20N4O6
Smiles	[O-][N+](c1cccc(/C=C/C(N(CC2)CCN2C(/C=C/c2cccc([N+]([O-])=O)c2)=O)=O)c1)=O
InChI	InChI=1S/C22H20N4O6/c27-21(9-7-17-3-1-5-19(15-17)25(29)30)23-11-13-24(14-12-23)22(28)10-8-18-4-2-6-20(16-18)26(31)32/h1-10,15-16H,11-14H2
InChIK	ZVETZYLABSOUPT-UHFFFAOYSA-N
TotalMolweight	436.423
Molweight	436.423
MonoisotopicMass	436.138286
CLogP	1.759
CLogS	-3.94
H Acceptors	10
TotalSurfaceArea	331
Relative PSA	0.28405
PolarSurfaceArea	132.26
Druglikeness	0.35903
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.625
Fragments	1
Non HAtoms	32
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Symmetricatoms	17
Amides	2
AcidicOxygens	2
StereoCon

Click to Load Molecule:

1 - (E)-3-(3-nitrophenyl)-1-[4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]piperazin-1-yl]prop-2-en-1-one | 2 - (E)-3-(3-nitrophenyl)-1-[4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]piperazin-1-yl]prop-2-en-1-one

Request More Details | (E)-3-(3-nitrophenyl)-1-[4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]piperazin-1-yl]prop-2-en-1-one

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments