N-[(Z)-1-(4-bromophenyl)-3-(furan-2-ylmethylamino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide

Formula:C21H16N2O3BrCl Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-1-(4-bromophenyl)-3-(furan-2-ylmethylamino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide is a drug-like molecule.

MolName	N-[(Z)-1-(4-bromophenyl)-3-(furan-2-ylmethylamino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide
MolecularFormula	C21H16N2O3BrCl
Smiles	O=C(/C(/NC(c(cccc1)c1Cl)=O)=C/c(cc1)ccc1Br)NCc1ccco1
InChI	InChI=1S/C21H16BrClN2O3/c22-15-9-7-14(8-10-15)12-19(21(27)24-13-16-4-3-11-28-16)25-20(26)17-5-1-2-6-18(17)23/h1-12H,13H2,(H,24,27)(H,25,26)
InChIK	DXAYZZYQMSAZNG-UHFFFAOYSA-N
TotalMolweight	459.726
Molweight	459.726
MonoisotopicMass	458.003281
CLogP	4.6531
CLogS	-5.941
H Acceptors	5
H Donors	2
TotalSurfaceArea	313.41
Relative PSA	0.20137
PolarSurfaceArea	71.34
Druglikeness	1.4009
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.46429
Fragments	1
Non HAtoms	28
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Symmetricatoms	2
Amides	2
StereoCon

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1 - N-[(Z)-1-(4-bromophenyl)-3-(furan-2-ylmethylamino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide | 2 - N-[(Z)-1-(4-bromophenyl)-3-(furan-2-ylmethylamino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide

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