(Z)-2-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile

Formula:C23H14NOCl2F3 Mutagenic:none Tumorigenic:high Reproductive Effective:high (Z)-2-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile is not a drug-like molecule.

MolName	(Z)-2-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile
MolecularFormula	C23H14NOCl2F3
Smiles	N#C/C(/c(cc1)ccc1OCc(cc1)cc(Cl)c1Cl)=C\c1ccc(C(F)(F)F)cc1
InChI	InChI=1S/C23H14Cl2F3NO/c24-21-10-3-16(12-22(21)25)14-30-20-8-4-17(5-9-20)18(13-29)11-15-1-6-19(7-2-15)23(26,27)28/h1-12H,14H2
InChIK	XWGZZCCWMVRXIL-UHFFFAOYSA-N
TotalMolweight	448.27
Molweight	448.27
MonoisotopicMass	447.040452
CLogP	6.741
CLogS	-7.22
H Acceptors	2
TotalSurfaceArea	323.26
Relative PSA	0.072883
PolarSurfaceArea	33.02
Druglikeness	-12.345
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.63333
Fragments	1
Non HAtoms	30
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	6
StereoCon

Click to Load Molecule:

1 - (Z)-2-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile | 2 - (Z)-2-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile

Request More Details | (Z)-2-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments