N-(4-chlorophenyl)-2-[4-[(Z)-(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-2-nitrophenoxy]acetamide

Formula:C24H17N4O6Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none N-(4-chlorophenyl)-2-[4-[(Z)-(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-2-nitrophenoxy]acetamide is a drug-like molecule.

MolName	N-(4-chlorophenyl)-2-[4-[(Z)-(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-2-nitrophenoxy]acetamide
MolecularFormula	C24H17N4O6Cl
Smiles	[O-][N+](c(cc(/C=C(/C(NN1c2ccccc2)=O)\C1=O)cc1)c1OCC(Nc(cc1)ccc1Cl)=O)=O
InChI	InChI=1S/C24H17ClN4O6/c25-16-7-9-17(10-8-16)26-22(30)14-35-21-11-6-15(13-20(21)29(33)34)12-19-23(31)27-28(24(19)32)18-4-2-1-3-5-18/h1-13H,14H2,(H,26,30)(H,27,31)
InChIK	RHBLZCBATDKYGU-UHFFFAOYSA-N
TotalMolweight	492.874
Molweight	492.874
MonoisotopicMass	492.083663
CLogP	1.7504
CLogS	-5.378
H Acceptors	10
H Donors	2
TotalSurfaceArea	353.31
Relative PSA	0.30005
PolarSurfaceArea	133.56
Druglikeness	-0.51448
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB; aromatic nitro
Shape Index	0.6
Fragments	1
Non HAtoms	35
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	4
Amides	1
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - N-(4-chlorophenyl)-2-[4-[(Z)-(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-2-nitrophenoxy]acetamide | 2 - N-(4-chlorophenyl)-2-[4-[(Z)-(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-2-nitrophenoxy]acetamide

Request More Details | N-(4-chlorophenyl)-2-[4-[(Z)-(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-2-nitrophenoxy]acetamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments