[2-oxo-2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl] (E)-3-phenylprop-2-enoate

Formula:C19H15NO5 Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-oxo-2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl] (E)-3-phenylprop-2-enoate is a drug-like molecule.

MolName	[2-oxo-2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl] (E)-3-phenylprop-2-enoate
MolecularFormula	C19H15NO5
Smiles	O=C(COC(/C=C/c1ccccc1)=O)c(cc1)cc(N2)c1OCC2=O
InChI	InChI=1S/C19H15NO5/c21-16(11-25-19(23)9-6-13-4-2-1-3-5-13)14-7-8-17-15(10-14)20-18(22)12-24-17/h1-10H,11-12H2,(H,20,22)
InChIK	CGQMITMCBSADEG-UHFFFAOYSA-N
TotalMolweight	337.33
Molweight	337.33
MonoisotopicMass	337.095024
CLogP	1.724
CLogS	-3.949
H Acceptors	6
H Donors	1
TotalSurfaceArea	258.25
Relative PSA	0.2733
PolarSurfaceArea	81.7
Druglikeness	0.92272
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.64
Fragments	1
Non HAtoms	25
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	2
Amides	1
StereoCon

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