N-[(Z)-1-(4-nitrophenyl)-3-[2-(4-nitrophenyl)hydrazinyl]-3-oxoprop-1-en-2-yl]benzamide

Formula:C22H17N5O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-1-(4-nitrophenyl)-3-[2-(4-nitrophenyl)hydrazinyl]-3-oxoprop-1-en-2-yl]benzamide is not a drug-like molecule.

MolName	N-[(Z)-1-(4-nitrophenyl)-3-[2-(4-nitrophenyl)hydrazinyl]-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C22H17N5O6
Smiles	[O-][N+](c1ccc(/C=C(/C(NNc(cc2)ccc2[N+]([O-])=O)=O)\NC(c2ccccc2)=O)cc1)=O
InChI	InChI=1S/C22H17N5O6/c28-21(16-4-2-1-3-5-16)23-20(14-15-6-10-18(11-7-15)26(30)31)22(29)25-24-17-8-12-19(13-9-17)27(32)33/h1-14,24H,(H,23,28)(H,25,29)
InChIK	MOEFHRJXCFSZDV-UHFFFAOYSA-N
TotalMolweight	447.406
Molweight	447.406
MonoisotopicMass	447.117885
CLogP	3.0304
CLogS	-5.403
H Acceptors	11
H Donors	3
TotalSurfaceArea	334.71
Relative PSA	0.3624
PolarSurfaceArea	161.87
Druglikeness	-0.86239
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.51515
Fragments	1
Non HAtoms	33
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	6
Amides	1
AcidicOxygens	2
StereoCon

Click to Load Molecule:

1 - N-[(Z)-1-(4-nitrophenyl)-3-[2-(4-nitrophenyl)hydrazinyl]-3-oxoprop-1-en-2-yl]benzamide | 2 - N-[(Z)-1-(4-nitrophenyl)-3-[2-(4-nitrophenyl)hydrazinyl]-3-oxoprop-1-en-2-yl]benzamide

Request More Details | N-[(Z)-1-(4-nitrophenyl)-3-[2-(4-nitrophenyl)hydrazinyl]-3-oxoprop-1-en-2-yl]benzamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments