[2-[(Z)-[[(Z)-2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazinylidene]methyl]-4,6-dibromophenyl] furan-2-carboxylate

Formula:C29H19N3O7Br2 Mutagenic:none Tumorigenic:none Reproductive Effective:high [2-[(Z)-[[(Z)-2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazinylidene]methyl]-4,6-dibromophenyl] furan-2-carboxylate is not a drug-like molecule.

MolName	[2-[(Z)-[[(Z)-2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazinylidene]methyl]-4,6-dibromophenyl] furan-2-carboxylate
MolecularFormula	C29H19N3O7Br2
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C/c(cc1)cc2c1OCO2)N/N=C\c1cc(Br)cc(Br)c1OC(c1ccco1)=O
InChI	InChI=1S/C29H19Br2N3O7/c30-20-13-19(26(21(31)14-20)41-29(37)24-7-4-10-38-24)15-32-34-28(36)22(33-27(35)18-5-2-1-3-6-18)11-17-8-9-23-25(12-17)40-16-39-23/h1-15H,16H2,(H,33,35)(H,34,36)
InChIK	RUFCLYYYKVSGBK-UHFFFAOYSA-N
TotalMolweight	681.292
Molweight	681.292
MonoisotopicMass	678.958974
CLogP	6.9993
CLogS	-8.997
H Acceptors	10
H Donors	2
TotalSurfaceArea	435.39
Relative PSA	0.27024
PolarSurfaceArea	128.46
Druglikeness	4.127
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.43902
Fragments	1
Non HAtoms	41
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	9
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	4
Symmetricatoms	2
Amides	1
StereoCon

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1 - [2-[(Z)-[[(Z)-2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazinylidene]methyl]-4,6-dibromophenyl] furan-2-carboxylate | 2 - [2-[(Z)-[[(Z)-2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazinylidene]methyl]-4,6-dibromophenyl] furan-2-carboxylate

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