(E)-3-[4-fluoro-2-(trifluoromethyl)phenyl]-1-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]prop-2-en-1-one

Formula:C23H19N3O3F4 Mutagenic:none Tumorigenic:none Reproductive Effective:low (E)-3-[4-fluoro-2-(trifluoromethyl)phenyl]-1-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-[4-fluoro-2-(trifluoromethyl)phenyl]-1-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]prop-2-en-1-one
MolecularFormula	C23H19N3O3F4
Smiles	O=C(/C=C/c(cc1)c(C(F)(F)F)cc1F)N1CC(COc2ncnc3ccccc23)OCC1
InChI	InChI=1S/C23H19F4N3O3/c24-16-7-5-15(19(11-16)23(25,26)27)6-8-21(31)30-9-10-32-17(12-30)13-33-22-18-3-1-2-4-20(18)28-14-29-22/h1-8,11,14,17H,9-10,12-13H2/t17-/m1/s1
InChIK	RIGMSNMSEXLBEG-QGZVFWFLSA-N
TotalMolweight	461.414
Molweight	461.414
MonoisotopicMass	461.136254
CLogP	4.0607
CLogS	-5.138
H Acceptors	6
TotalSurfaceArea	329.54
Relative PSA	0.17761
PolarSurfaceArea	64.55
Druglikeness	-4.1817
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	10
Electronegative Atoms	10
StereoCenters	1
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	8
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	2
StereoCon	racemate

Click to Load Molecule:

1 - (E)-3-[4-fluoro-2-(trifluoromethyl)phenyl]-1-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]prop-2-en-1-one | 2 - (E)-3-[4-fluoro-2-(trifluoromethyl)phenyl]-1-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]prop-2-en-1-one

Request More Details | (E)-3-[4-fluoro-2-(trifluoromethyl)phenyl]-1-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]prop-2-en-1-one

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments