2-(4-chlorophenyl)-4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one

Formula:C23H22NO5Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(4-chlorophenyl)-4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one is a drug-like molecule.

MolName	2-(4-chlorophenyl)-4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one
MolecularFormula	C23H22NO5Cl
Smiles	OCCOCCN(C(C(C(/C=C/c1ccccc1)=O)=C1O)c(cc2)ccc2Cl)C1=O
InChI	InChI=1S/C23H22ClNO5/c24-18-9-7-17(8-10-18)21-20(19(27)11-6-16-4-2-1-3-5-16)22(28)23(29)25(21)12-14-30-15-13-26/h1-11,21,26,28H,12-15H2/t21-/m1/s1
InChIK	WNAHBHNLQTUVRK-OAQYLSRUSA-N
TotalMolweight	427.883
Molweight	427.883
MonoisotopicMass	427.118651
CLogP	2.4379
CLogS	-3.308
H Acceptors	6
H Donors	2
TotalSurfaceArea	320.4
Relative PSA	0.20546
PolarSurfaceArea	87.07
Druglikeness	1.5112
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions	limit! 4-acyl-3-azoline-2-one-3-ol
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	9
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	8
Symmetricatoms	4
Amides	1
StereoCon	racemate

Click to Load Molecule:

1 - 2-(4-chlorophenyl)-4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one | 2 - 2-(4-chlorophenyl)-4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one

Request More Details | 2-(4-chlorophenyl)-4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments