(Z)-1-[3,5-dichloro-4-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine

Formula:C20H18N4O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-[3,5-dichloro-4-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine is a drug-like molecule.

MolName	(Z)-1-[3,5-dichloro-4-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine
MolecularFormula	C20H18N4O2Cl2
Smiles	C=CCc(cccc1)c1OCCOc(c(Cl)cc(/C=N\n1cnnc1)c1)c1Cl
InChI	InChI=1S/C20H18Cl2N4O2/c1-2-5-16-6-3-4-7-19(16)27-8-9-28-20-17(21)10-15(11-18(20)22)12-25-26-13-23-24-14-26/h2-4,6-7,10-14H,1,5,8-9H2
InChIK	NFBTUCXQMIQGSW-UHFFFAOYSA-N
TotalMolweight	417.295
Molweight	417.295
MonoisotopicMass	416.08068
CLogP	4.8237
CLogS	-7.762
H Acceptors	6
TotalSurfaceArea	320.92
Relative PSA	0.18796
PolarSurfaceArea	61.53
Druglikeness	-6.6229
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.64286
Fragments	1
Non HAtoms	28
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	9
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	5
Symmetricatoms	5
Aromatic Nitrogens	3
StereoCon

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1 - (Z)-1-[3,5-dichloro-4-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine | 2 - (Z)-1-[3,5-dichloro-4-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine

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