[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl] (E)-3-(2,4-dichlorophenyl)prop-2-enoate

Formula:C19H15NO5Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl] (E)-3-(2,4-dichlorophenyl)prop-2-enoate is a drug-like molecule.

MolName	[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl] (E)-3-(2,4-dichlorophenyl)prop-2-enoate
MolecularFormula	C19H15NO5Cl2
Smiles	O=C(COC(/C=C/c(ccc(Cl)c1)c1Cl)=O)Nc(cc1)cc2c1OCCO2
InChI	InChI=1S/C19H15Cl2NO5/c20-13-3-1-12(15(21)9-13)2-6-19(24)27-11-18(23)22-14-4-5-16-17(10-14)26-8-7-25-16/h1-6,9-10H,7-8,11H2,(H,22,23)
InChIK	FFEYGVPRULMULX-UHFFFAOYSA-N
TotalMolweight	408.236
Molweight	408.236
MonoisotopicMass	407.032728
CLogP	3.885
CLogS	-5.055
H Acceptors	6
H Donors	1
TotalSurfaceArea	295.1
Relative PSA	0.22887
PolarSurfaceArea	73.86
Druglikeness	-6.7083
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.66667
Fragments	1
Non HAtoms	27
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Amides	1
StereoCon

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1 - [2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl] (E)-3-(2,4-dichlorophenyl)prop-2-enoate | 2 - [2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl] (E)-3-(2,4-dichlorophenyl)prop-2-enoate

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