2-(2-nitrophenoxy)-N-[(Z)-(5-nitrothiophen-2-yl)methylideneamino]acetamide

Formula:C13H10N4O6S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(2-nitrophenoxy)-N-[(Z)-(5-nitrothiophen-2-yl)methylideneamino]acetamide is a drug-like molecule.

MolName	2-(2-nitrophenoxy)-N-[(Z)-(5-nitrothiophen-2-yl)methylideneamino]acetamide
MolecularFormula	C13H10N4O6S
Smiles	[O-][N+](c1ccc(/C=N\NC(COc(cccc2)c2[N+]([O-])=O)=O)s1)=O
InChI	InChI=1S/C13H10N4O6S/c18-12(8-23-11-4-2-1-3-10(11)16(19)20)15-14-7-9-5-6-13(24-9)17(21)22/h1-7H,8H2,(H,15,18)
InChIK	OOFMHGDAOQQZPX-UHFFFAOYSA-N
TotalMolweight	350.31
Molweight	350.31
MonoisotopicMass	350.032106
CLogP	0.9895
CLogS	-4.581
H Acceptors	10
H Donors	1
TotalSurfaceArea	254.03
Relative PSA	0.50077
PolarSurfaceArea	170.57
Druglikeness	0.36775
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.625
Fragments	1
Non HAtoms	24
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	4
AcidicOxygens	2
StereoCon

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