2-[(1-bromo-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide

Formula:C17H17N2O2BrS Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(1-bromo-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide is a drug-like molecule.

MolName	2-[(1-bromo-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide
MolecularFormula	C17H17N2O2BrS
Smiles	O=C(COc(ccc1c2CCCC1)c2Br)N/N=C\c1cccs1
InChI	InChI=1S/C17H17BrN2O2S/c18-17-14-6-2-1-4-12(14)7-8-15(17)22-11-16(21)20-19-10-13-5-3-9-23-13/h3,5,7-10H,1-2,4,6,11H2,(H,20,21)
InChIK	YHSPCAJKZGIMOF-UHFFFAOYSA-N
TotalMolweight	393.304
Molweight	393.304
MonoisotopicMass	392.019409
CLogP	4.5251
CLogS	-5.437
H Acceptors	4
H Donors	1
TotalSurfaceArea	266.86
Relative PSA	0.24871
PolarSurfaceArea	78.93
Druglikeness	-1.279
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.65217
Fragments	1
Non HAtoms	23
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	6
StereoCon

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1 - 2-[(1-bromo-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide | 2 - 2-[(1-bromo-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide

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