2,4-dichloro-N-[(Z)-3-oxo-3-[[(2S)-oxolan-2-yl]methylamino]-1-phenylprop-1-en-2-yl]benzamide

Formula:C21H20N2O3Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2,4-dichloro-N-[(Z)-3-oxo-3-[[(2S)-oxolan-2-yl]methylamino]-1-phenylprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	2,4-dichloro-N-[(Z)-3-oxo-3-[[(2S)-oxolan-2-yl]methylamino]-1-phenylprop-1-en-2-yl]benzamide
MolecularFormula	C21H20N2O3Cl2
Smiles	O=C(/C(/NC(c(ccc(Cl)c1)c1Cl)=O)=C/c1ccccc1)NC[C@H]1OCCC1
InChI	InChI=1S/C21H20Cl2N2O3/c22-15-8-9-17(18(23)12-15)20(26)25-19(11-14-5-2-1-3-6-14)21(27)24-13-16-7-4-10-28-16/h1-3,5-6,8-9,11-12,16H,4,7,10,13H2,(H,24,27)(H,25,26)/t16-/m0/s1
InChIK	CYJOQVVDPFLFME-INIZCTEOSA-N
TotalMolweight	419.307
Molweight	419.307
MonoisotopicMass	418.085097
CLogP	4.2269
CLogS	-5.523
H Acceptors	5
H Donors	2
TotalSurfaceArea	311.03
Relative PSA	0.18969
PolarSurfaceArea	67.43
Druglikeness	2.2961
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Symmetricatoms	2
Amides	2
StereoCon	this enantiomer

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