N-[(Z)-anthracen-9-ylmethylideneamino]-2-[N-(benzenesulfonyl)-2-chloroanilino]acetamide

Formula:C29H22N3O3ClS Mutagenic:high Tumorigenic:high Reproductive Effective:none N-[(Z)-anthracen-9-ylmethylideneamino]-2-[N-(benzenesulfonyl)-2-chloroanilino]acetamide is not a drug-like molecule.

MolName	N-[(Z)-anthracen-9-ylmethylideneamino]-2-[N-(benzenesulfonyl)-2-chloroanilino]acetamide
MolecularFormula	C29H22N3O3ClS
Smiles	O=C(CN(c(cccc1)c1Cl)S(c1ccccc1)(=O)=O)N/N=C\c1c(cccc2)c2cc2ccccc12
InChI	InChI=1S/C29H22ClN3O3S/c30-27-16-8-9-17-28(27)33(37(35,36)23-12-2-1-3-13-23)20-29(34)32-31-19-26-24-14-6-4-10-21(24)18-22-11-5-7-15-25(22)26/h1-19H,20H2,(H,32,34)
InChIK	OEFRSGSHRYQQOW-UHFFFAOYSA-N
TotalMolweight	528.031
Molweight	528.031
MonoisotopicMass	527.107039
CLogP	6.0456
CLogS	-8.874
H Acceptors	6
H Donors	1
TotalSurfaceArea	384.01
Relative PSA	0.17744
PolarSurfaceArea	87.22
Druglikeness	-2.5458
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	high
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.43243
Fragments	1
Non HAtoms	37
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	26
Sp3Atoms	2
Symmetricatoms	9
Amides	1
StereoCon

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