N-[(Z)-[5-(2-bromophenyl)furan-2-yl]methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide

Formula:C22H16N3O4BrS2 Mutagenic:high Tumorigenic:high Reproductive Effective:none N-[(Z)-[5-(2-bromophenyl)furan-2-yl]methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide is not a drug-like molecule.

MolName	N-[(Z)-[5-(2-bromophenyl)furan-2-yl]methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide
MolecularFormula	C22H16N3O4BrS2
Smiles	O=C(c(cc1)ccc1NS(c1cccs1)(=O)=O)N/N=C\c1ccc(-c(cccc2)c2Br)o1
InChI	InChI=1S/C22H16BrN3O4S2/c23-19-5-2-1-4-18(19)20-12-11-17(30-20)14-24-25-22(27)15-7-9-16(10-8-15)26-32(28,29)21-6-3-13-31-21/h1-14,26H,(H,25,27)
InChIK	UJWSTRYHZOKMIV-UHFFFAOYSA-N
TotalMolweight	530.422
Molweight	530.422
MonoisotopicMass	528.976558
CLogP	5.1539
CLogS	-7.265
H Acceptors	7
H Donors	2
TotalSurfaceArea	350.81
Relative PSA	0.31504
PolarSurfaceArea	137.39
Druglikeness	4.6314
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.625
Fragments	1
Non HAtoms	32
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	1
Symmetricatoms	3
Amides	1
StereoCon

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