(E)-N-(2-hydroxyethyl)-N-(2-hydroxy-2-phenylethyl)-3-(2-nitrophenyl)prop-2-enamide

Formula:C19H20N2O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-(2-hydroxyethyl)-N-(2-hydroxy-2-phenylethyl)-3-(2-nitrophenyl)prop-2-enamide is a drug-like molecule.

MolName	(E)-N-(2-hydroxyethyl)-N-(2-hydroxy-2-phenylethyl)-3-(2-nitrophenyl)prop-2-enamide
MolecularFormula	C19H20N2O5
Smiles	[O-][N+](c1c(/C=C/C(N(CCO)CC(c2ccccc2)O)=O)cccc1)=O
InChI	InChI=1S/C19H20N2O5/c22-13-12-20(14-18(23)16-7-2-1-3-8-16)19(24)11-10-15-6-4-5-9-17(15)21(25)26/h1-11,18,22-23H,12-14H2/t18-/m0/s1
InChIK	LPBWAUYIAJTYML-SFHVURJKSA-N
TotalMolweight	356.377
Molweight	356.377
MonoisotopicMass	356.137223
CLogP	1.0302
CLogS	-2.769
H Acceptors	7
H Donors	2
TotalSurfaceArea	277.72
Relative PSA	0.26361
PolarSurfaceArea	106.59
Druglikeness	-1.551
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.53846
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	8
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	7
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon	racemate

Click to Load Molecule:

1 - (E)-N-(2-hydroxyethyl)-N-(2-hydroxy-2-phenylethyl)-3-(2-nitrophenyl)prop-2-enamide | 2 - (E)-N-(2-hydroxyethyl)-N-(2-hydroxy-2-phenylethyl)-3-(2-nitrophenyl)prop-2-enamide

Request More Details | (E)-N-(2-hydroxyethyl)-N-(2-hydroxy-2-phenylethyl)-3-(2-nitrophenyl)prop-2-enamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments