[3-benzoyloxy-4-[(Z)-[[2-(2,3-dichlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] benzoate

Formula:C29H20N2O6Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:high [3-benzoyloxy-4-[(Z)-[[2-(2,3-dichlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] benzoate is not a drug-like molecule.

MolName	[3-benzoyloxy-4-[(Z)-[[2-(2,3-dichlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] benzoate
MolecularFormula	C29H20N2O6Cl2
Smiles	O=C(COc1cccc(Cl)c1Cl)N/N=C\c(ccc(OC(c1ccccc1)=O)c1)c1OC(c1ccccc1)=O
InChI	InChI=1S/C29H20Cl2N2O6/c30-23-12-7-13-24(27(23)31)37-18-26(34)33-32-17-21-14-15-22(38-28(35)19-8-3-1-4-9-19)16-25(21)39-29(36)20-10-5-2-6-11-20/h1-17H,18H2,(H,33,34)
InChIK	YTYGYHIJUZKPAL-UHFFFAOYSA-N
TotalMolweight	563.392
Molweight	563.392
MonoisotopicMass	562.069842
CLogP	6.8495
CLogS	-7.913
H Acceptors	8
H Donors	1
TotalSurfaceArea	416.61
Relative PSA	0.22105
PolarSurfaceArea	103.29
Druglikeness	4.0206
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	high
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.51282
Fragments	1
Non HAtoms	39
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	11
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	4
Symmetricatoms	4
StereoCon

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