3-(3-bromophenoxy)-N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]propanamide

Formula:C16H15N2O3Br Mutagenic:high Tumorigenic:none Reproductive Effective:none 3-(3-bromophenoxy)-N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]propanamide is a drug-like molecule.

MolName	3-(3-bromophenoxy)-N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]propanamide
MolecularFormula	C16H15N2O3Br
Smiles	O=C(CCOc1cccc(Br)c1)N/N=C\C=C\c1ccco1
InChI	InChI=1S/C16H15BrN2O3/c17-13-4-1-5-15(12-13)22-11-8-16(20)19-18-9-2-6-14-7-3-10-21-14/h1-7,9-10,12H,8,11H2,(H,19,20)
InChIK	WJAKTYLDCACHPT-UHFFFAOYSA-N
TotalMolweight	363.21
Molweight	363.21
MonoisotopicMass	362.026604
CLogP	3.1631
CLogS	-4.579
H Acceptors	5
H Donors	1
TotalSurfaceArea	259.33
Relative PSA	0.23183
PolarSurfaceArea	63.83
Druglikeness	2.1447
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.72727
Fragments	1
Non HAtoms	22
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
StereoCon

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