2-[(Z)-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]hydrazinylidene]methyl]benzoate

Formula:C17H14N2O3BrS Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(Z)-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]hydrazinylidene]methyl]benzoate is a drug-like molecule.

MolName	2-[(Z)-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]hydrazinylidene]methyl]benzoate
MolecularFormula	C17H14N2O3BrS
Smiles	[O-]C(c1c(/C=N\NC(CSCc(cccc2)c2Br)=O)cccc1)=O
InChI	InChI=1S/C17H15BrN2O3S/c18-15-8-4-2-6-13(15)10-24-11-16(21)20-19-9-12-5-1-3-7-14(12)17(22)23/h1-9H,10-11H2,(H,20,21)(H,22,23)/p-1
InChIK	DPBABITYWXYSDQ-UHFFFAOYSA-M
TotalMolweight	406.279
Molweight	406.279
MonoisotopicMass	404.990849
CLogP	1.5255
CLogS	-5.354
H Acceptors	5
H Donors	1
TotalSurfaceArea	275.91
Relative PSA	0.29292
PolarSurfaceArea	106.89
Druglikeness	2.9143
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.625
Fragments	1
Non HAtoms	24
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
AcidicOxygens	1
StereoCon

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