(5E)-5-[[3-bromo-4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-1-(3-bromophenyl)-1,3-diazinane-2,4,6-trione

Formula:C24H15N2O4Br2F Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-5-[[3-bromo-4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-1-(3-bromophenyl)-1,3-diazinane-2,4,6-trione is not a drug-like molecule.

MolName(5E)-5-[[3-bromo-4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-1-(3-bromophenyl)-1,3-diazinane-2,4,6-trione
MolecularFormulaC24H15N2O4Br2F
SmilesO=C(/C(/C(N1c2cc(Br)ccc2)=O)=C\c(cc2)cc(Br)c2OCc(cc2)ccc2F)NC1=O
InChIInChI=1S/C24H15Br2FN2O4/c25-16-2-1-3-18(12-16)29-23(31)19(22(30)28-24(29)32)10-15-6-9-21(20(26)11-15)33-13-14-4-7-17(27)8-5-14/h1-12H,13H2,(H,28,30,32)
InChIKSUZAWDKMLOUGQZ-UHFFFAOYSA-N
TotalMolweight574.199
Molweight574.199
MonoisotopicMass571.938258
CLogP5.0547
CLogS-7.21
H Acceptors6
H Donors1
TotalSurfaceArea346.37
Relative PSA0.18515
PolarSurfaceArea75.71
Druglikeness1.3873
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functionstwice activated DB
Shape Index0.57576
Fragments1
Non HAtoms33
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Symmetricatoms2
Amides2
StereoCon

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