2-(2,5-dichlorophenoxy)-N-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]acetamide

Formula:C19H13N3O5Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high 2-(2,5-dichlorophenoxy)-N-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]acetamide is a drug-like molecule.

MolName	2-(2,5-dichlorophenoxy)-N-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]acetamide
MolecularFormula	C19H13N3O5Cl2
Smiles	[O-][N+](c(cc1)ccc1-c1ccc(/C=N/NC(COc(cc(cc2)Cl)c2Cl)=O)o1)=O
InChI	InChI=1S/C19H13Cl2N3O5/c20-13-3-7-16(21)18(9-13)28-11-19(25)23-22-10-15-6-8-17(29-15)12-1-4-14(5-2-12)24(26)27/h1-10H,11H2,(H,23,25)
InChIK	MROCWVXWUIRPSS-UHFFFAOYSA-N
TotalMolweight	434.234
Molweight	434.234
MonoisotopicMass	433.023226
CLogP	4.0058
CLogS	-6.893
H Acceptors	8
H Donors	1
TotalSurfaceArea	314.71
Relative PSA	0.28769
PolarSurfaceArea	109.65
Druglikeness	1.3799
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.65517
Fragments	1
Non HAtoms	29
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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