2-[2-[(Z)-[[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]hydrazinylidene]methyl]phenoxy]acetonitrile

Formula:C16H8N3OF7 Mutagenic:none Tumorigenic:none Reproductive Effective:high 2-[2-[(Z)-[[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]hydrazinylidene]methyl]phenoxy]acetonitrile is not a drug-like molecule.

MolName	2-[2-[(Z)-[[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]hydrazinylidene]methyl]phenoxy]acetonitrile
MolecularFormula	C16H8N3OF7
Smiles	N#CCOc1c(/C=N\Nc(c(F)c(c(C(F)(F)F)c2F)F)c2F)cccc1
InChI	InChI=1S/C16H8F7N3O/c17-11-10(16(21,22)23)12(18)14(20)15(13(11)19)26-25-7-8-3-1-2-4-9(8)27-6-5-24/h1-4,7,26H,6H2
InChIK	KJXQTARERORJMT-UHFFFAOYSA-N
TotalMolweight	391.246
Molweight	391.246
MonoisotopicMass	391.055558
CLogP	5.6743
CLogS	-5.649
H Acceptors	4
H Donors	1
TotalSurfaceArea	269.57
Relative PSA	0.17261
PolarSurfaceArea	57.41
Druglikeness	-9.8412
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde; polyhalo aromatic ring
Shape Index	0.55556
Fragments	1
Non HAtoms	27
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	6
StereoCon

Click to Load Molecule:

1 - 2-[2-[(Z)-[[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]hydrazinylidene]methyl]phenoxy]acetonitrile | 2 - 2-[2-[(Z)-[[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]hydrazinylidene]methyl]phenoxy]acetonitrile

Request More Details | 2-[2-[(Z)-[[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]hydrazinylidene]methyl]phenoxy]acetonitrile

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments