[4-bromo-2-[(Z)-[[2-[(4-chlorophenyl)sulfonylamino]benzoyl]hydrazinylidene]methyl]phenyl] benzoate

Formula:C27H19N3O5BrClS Mutagenic:high Tumorigenic:none Reproductive Effective:none [4-bromo-2-[(Z)-[[2-[(4-chlorophenyl)sulfonylamino]benzoyl]hydrazinylidene]methyl]phenyl] benzoate is not a drug-like molecule.

MolName	[4-bromo-2-[(Z)-[[2-[(4-chlorophenyl)sulfonylamino]benzoyl]hydrazinylidene]methyl]phenyl] benzoate
MolecularFormula	C27H19N3O5BrClS
Smiles	O=C(c(cccc1)c1NS(c(cc1)ccc1Cl)(=O)=O)N/N=C\c(cc(cc1)Br)c1OC(c1ccccc1)=O
InChI	InChI=1S/C27H19BrClN3O5S/c28-20-10-15-25(37-27(34)18-6-2-1-3-7-18)19(16-20)17-30-31-26(33)23-8-4-5-9-24(23)32-38(35,36)22-13-11-21(29)12-14-22/h1-17,32H,(H,31,33)
InChIK	LLHVVOTXEBDWRC-UHFFFAOYSA-N
TotalMolweight	612.887
Molweight	612.887
MonoisotopicMass	610.99173
CLogP	6.2624
CLogS	-8.094
H Acceptors	8
H Donors	2
TotalSurfaceArea	408.35
Relative PSA	0.24266
PolarSurfaceArea	122.31
Druglikeness	5.5954
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.55263
Fragments	1
Non HAtoms	38
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	2
Symmetricatoms	5
Amides	1
StereoCon

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