2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(Z)-[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]acetamide

Formula:C28H24N2O4 Mutagenic:low Tumorigenic:high Reproductive Effective:none 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(Z)-[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]acetamide is not a drug-like molecule.

MolName	2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(Z)-[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]acetamide
MolecularFormula	C28H24N2O4
Smiles	O=C(Cc(cc1)cc2c1OCCO2)N/N=C\c(cccc1)c1OCc1cccc2ccccc12
InChI	InChI=1S/C28H24N2O4/c31-28(17-20-12-13-26-27(16-20)33-15-14-32-26)30-29-18-22-7-2-4-11-25(22)34-19-23-9-5-8-21-6-1-3-10-24(21)23/h1-13,16,18H,14-15,17,19H2,(H,30,31)
InChIK	PYFGBVHGRYMVEG-UHFFFAOYSA-N
TotalMolweight	452.509
Molweight	452.509
MonoisotopicMass	452.173608
CLogP	5.721
CLogS	-6.815
H Acceptors	6
H Donors	1
TotalSurfaceArea	352.89
Relative PSA	0.18706
PolarSurfaceArea	69.15
Druglikeness	-2.8714
Mutagenic	low
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.58824
Fragments	1
Non HAtoms	34
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	7
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	7
StereoCon

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1 - 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(Z)-[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]acetamide | 2 - 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(Z)-[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]acetamide

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