(2Z)-2-[(4Z)-3-chloro-4-hydroxyiminocyclohexa-2,5-dien-1-ylidene]-2-(4-chlorophenyl)acetonitrile

Formula:C14H8N2OCl2 Mutagenic:low Tumorigenic:low Reproductive Effective:low (2Z)-2-[(4Z)-3-chloro-4-hydroxyiminocyclohexa-2,5-dien-1-ylidene]-2-(4-chlorophenyl)acetonitrile is a drug-like molecule.

MolName	(2Z)-2-[(4Z)-3-chloro-4-hydroxyiminocyclohexa-2,5-dien-1-ylidene]-2-(4-chlorophenyl)acetonitrile
MolecularFormula	C14H8N2OCl2
Smiles	N#C/C(/c(cc1)ccc1Cl)=C(/C=C/C1=N/O)\C=C1Cl
InChI	InChI=1S/C14H8Cl2N2O/c15-11-4-1-9(2-5-11)12(8-17)10-3-6-14(18-19)13(16)7-10/h1-7,19H
InChIK	KASFVGQOBYGUEY-UHFFFAOYSA-N
TotalMolweight	291.137
Molweight	291.137
MonoisotopicMass	290.001367
CLogP	3.6527
CLogS	-4.419
H Acceptors	3
H Donors	1
TotalSurfaceArea	215.76
Relative PSA	0.17691
PolarSurfaceArea	56.38
Druglikeness	-4.7895
Mutagenic	low
Tumorigenic	low
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.63158
Fragments	1
Non HAtoms	19
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	1
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	1
Symmetricatoms	2
StereoCon

Click to Load Molecule:

1 - (2Z)-2-[(4Z)-3-chloro-4-hydroxyiminocyclohexa-2,5-dien-1-ylidene]-2-(4-chlorophenyl)acetonitrile | 2 - (2Z)-2-[(4Z)-3-chloro-4-hydroxyiminocyclohexa-2,5-dien-1-ylidene]-2-(4-chlorophenyl)acetonitrile

Request More Details | (2Z)-2-[(4Z)-3-chloro-4-hydroxyiminocyclohexa-2,5-dien-1-ylidene]-2-(4-chlorophenyl)acetonitrile

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments