N-[(E)-3-(benzylamino)-1-(3-bromophenyl)-3-oxoprop-1-en-2-yl]benzamide

Formula:C23H19N2O2Br Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(E)-3-(benzylamino)-1-(3-bromophenyl)-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	N-[(E)-3-(benzylamino)-1-(3-bromophenyl)-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C23H19N2O2Br
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C\c1cccc(Br)c1)NCc1ccccc1
InChI	InChI=1S/C23H19BrN2O2/c24-20-13-7-10-18(14-20)15-21(26-22(27)19-11-5-2-6-12-19)23(28)25-16-17-8-3-1-4-9-17/h1-15H,16H2,(H,25,28)(H,26,27)
InChIK	CJTBMONJLQJUAH-UHFFFAOYSA-N
TotalMolweight	435.32
Molweight	435.32
MonoisotopicMass	434.062989
CLogP	4.8584
CLogS	-5.523
H Acceptors	4
H Donors	2
TotalSurfaceArea	308.3
Relative PSA	0.15894
PolarSurfaceArea	58.2
Druglikeness	1.6237
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	1
Symmetricatoms	4
Amides	2
StereoCon

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