(5Z)-5-[[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione

Formula:C28H19N2O5F Mutagenic:high Tumorigenic:high Reproductive Effective:high (5Z)-5-[[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5Z)-5-[[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione
MolecularFormula	C28H19N2O5F
Smiles	Oc(cc1)ccc1N(C(/C(/C(N1)=O)=C\c(c2ccccc2cc2)c2OCc2cccc(F)c2)=O)C1=O
InChI	InChI=1S/C28H19FN2O5/c29-19-6-3-4-17(14-19)16-36-25-13-8-18-5-1-2-7-22(18)23(25)15-24-26(33)30-28(35)31(27(24)34)20-9-11-21(32)12-10-20/h1-15,32H,16H2,(H,30,33,35)
InChIK	LJBVRPYQHRRXEL-UHFFFAOYSA-N
TotalMolweight	482.466
Molweight	482.466
MonoisotopicMass	482.127801
CLogP	4.453
CLogS	-6.852
H Acceptors	7
H Donors	2
TotalSurfaceArea	350.06
Relative PSA	0.22062
PolarSurfaceArea	95.94
Druglikeness	3.1984
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.47222
Fragments	1
Non HAtoms	36
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	3
Symmetricatoms	2
Amides	2
StereoCon

Click to Load Molecule:

1 - (5Z)-5-[[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione | 2 - (5Z)-5-[[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione

Request More Details | (5Z)-5-[[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methylidene]-1-(4-hydroxyphenyl)-1,3-diazinane-2,4,6-trione

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments