4-bromo-N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]benzamide

Formula:C16H12N2OBrCl Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-bromo-N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]benzamide is a drug-like molecule.

MolName	4-bromo-N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]benzamide
MolecularFormula	C16H12N2OBrCl
Smiles	O=C(c(cc1)ccc1Br)N/N=C\C(\Cl)=C\c1ccccc1
InChI	InChI=1S/C16H12BrClN2O/c17-14-8-6-13(7-9-14)16(21)20-19-11-15(18)10-12-4-2-1-3-5-12/h1-11H,(H,20,21)
InChIK	PRKXVRAKPNCHSS-UHFFFAOYSA-N
TotalMolweight	363.641
Molweight	363.641
MonoisotopicMass	361.982151
CLogP	4.4067
CLogS	-5.538
H Acceptors	3
H Donors	1
TotalSurfaceArea	245.75
Relative PSA	0.14653
PolarSurfaceArea	41.46
Druglikeness	2.863
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.71429
Fragments	1
Non HAtoms	21
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Symmetricatoms	4
StereoCon

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