N-[2-[(4-bromophenyl)carbamoyl]phenyl]-N'-[(Z)-(6-chloro-4-oxochromen-3-yl)methylideneamino]oxamide

Formula:C25H16N4O5BrCl Mutagenic:none Tumorigenic:high Reproductive Effective:none N-[2-[(4-bromophenyl)carbamoyl]phenyl]-N'-[(Z)-(6-chloro-4-oxochromen-3-yl)methylideneamino]oxamide is not a drug-like molecule.

MolName	N-[2-[(4-bromophenyl)carbamoyl]phenyl]-N'-[(Z)-(6-chloro-4-oxochromen-3-yl)methylideneamino]oxamide
MolecularFormula	C25H16N4O5BrCl
Smiles	O=C(C(N/N=C\C1=COc(ccc(Cl)c2)c2C1=O)=O)Nc(cccc1)c1C(Nc(cc1)ccc1Br)=O
InChI	InChI=1S/C25H16BrClN4O5/c26-15-5-8-17(9-6-15)29-23(33)18-3-1-2-4-20(18)30-24(34)25(35)31-28-12-14-13-36-21-10-7-16(27)11-19(21)22(14)32/h1-13H,(H,29,33)(H,30,34)(H,31,35)
InChIK	OGKDWQDCSYDXAQ-UHFFFAOYSA-N
TotalMolweight	567.782
Molweight	567.782
MonoisotopicMass	565.999259
CLogP	3.74
CLogS	-7.157
H Acceptors	9
H Donors	3
TotalSurfaceArea	378.18
Relative PSA	0.28571
PolarSurfaceArea	125.96
Druglikeness	2.4628
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB; acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide
Shape Index	0.58333
Fragments	1
Non HAtoms	36
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	1
Symmetricatoms	2
Amides	2
StereoCon

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1 - N-[2-[(4-bromophenyl)carbamoyl]phenyl]-N'-[(Z)-(6-chloro-4-oxochromen-3-yl)methylideneamino]oxamide | 2 - N-[2-[(4-bromophenyl)carbamoyl]phenyl]-N'-[(Z)-(6-chloro-4-oxochromen-3-yl)methylideneamino]oxamide

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