[4-[(Z)-[[2-(4-phenylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 1,3-benzodioxole-5-carboxylate

Formula:C29H22N2O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none [4-[(Z)-[[2-(4-phenylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 1,3-benzodioxole-5-carboxylate is not a drug-like molecule.

MolName	[4-[(Z)-[[2-(4-phenylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 1,3-benzodioxole-5-carboxylate
MolecularFormula	C29H22N2O6
Smiles	O=C(COc(cc1)ccc1-c1ccccc1)N/N=C\c(cc1)ccc1OC(c(cc1)cc2c1OCO2)=O
InChI	InChI=1S/C29H22N2O6/c32-28(18-34-24-13-8-22(9-14-24)21-4-2-1-3-5-21)31-30-17-20-6-11-25(12-7-20)37-29(33)23-10-15-26-27(16-23)36-19-35-26/h1-17H,18-19H2,(H,31,32)
InChIK	DMTRAYBQKHLBRC-UHFFFAOYSA-N
TotalMolweight	494.502
Molweight	494.502
MonoisotopicMass	494.147788
CLogP	5.9776
CLogS	-7.768
H Acceptors	8
H Donors	1
TotalSurfaceArea	378.28
Relative PSA	0.23541
PolarSurfaceArea	95.45
Druglikeness	3.9371
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.67568
Fragments	1
Non HAtoms	37
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	9
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	6
Symmetricatoms	6
StereoCon

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