4-[(Z)-(2,4-dichlorophenyl)methylideneamino]-3-(4-fluorophenyl)-1H-1,2,4-triazole-5-thione

Formula:C15H9N4Cl2FS Mutagenic:high Tumorigenic:none Reproductive Effective:high 4-[(Z)-(2,4-dichlorophenyl)methylideneamino]-3-(4-fluorophenyl)-1H-1,2,4-triazole-5-thione is a drug-like molecule.

MolName	4-[(Z)-(2,4-dichlorophenyl)methylideneamino]-3-(4-fluorophenyl)-1H-1,2,4-triazole-5-thione
MolecularFormula	C15H9N4Cl2FS
Smiles	Fc(cc1)ccc1C(N1/N=C\c(ccc(Cl)c2)c2Cl)=NNC1=S
InChI	InChI=1S/C15H9Cl2FN4S/c16-11-4-1-10(13(17)7-11)8-19-22-14(20-21-15(22)23)9-2-5-12(18)6-3-9/h1-8H,(H,21,23)
InChIK	HICPKKAECHHRNP-UHFFFAOYSA-N
TotalMolweight	367.234
Molweight	367.234
MonoisotopicMass	365.990898
CLogP	4.6078
CLogS	-6.237
H Acceptors	4
H Donors	1
TotalSurfaceArea	258.91
Relative PSA	0.25503
PolarSurfaceArea	72.08
Druglikeness	2.2745
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde; thio-amide/urea
Shape Index	0.6087
Fragments	1
Non HAtoms	23
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
StereoCon

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1 - 4-[(Z)-(2,4-dichlorophenyl)methylideneamino]-3-(4-fluorophenyl)-1H-1,2,4-triazole-5-thione | 2 - 4-[(Z)-(2,4-dichlorophenyl)methylideneamino]-3-(4-fluorophenyl)-1H-1,2,4-triazole-5-thione

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