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

Formula:C24H16N2O4Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-1-(4-chlorophenyl)-5-[[4-[(2-chlorophenyl)methoxy]phenyl]methylidene]-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName(5E)-1-(4-chlorophenyl)-5-[[4-[(2-chlorophenyl)methoxy]phenyl]methylidene]-1,3-diazinane-2,4,6-trione
MolecularFormulaC24H16N2O4Cl2
SmilesO=C(/C(/C(N1c(cc2)ccc2Cl)=O)=C\c(cc2)ccc2OCc(cccc2)c2Cl)NC1=O
InChIInChI=1S/C24H16Cl2N2O4/c25-17-7-9-18(10-8-17)28-23(30)20(22(29)27-24(28)31)13-15-5-11-19(12-6-15)32-14-16-3-1-2-4-21(16)26/h1-13H,14H2,(H,27,29,31)
InChIKFMKGYGFDHXFHQF-UHFFFAOYSA-N
TotalMolweight467.307
Molweight467.307
MonoisotopicMass466.048712
CLogP4.7155
CLogS-6.7
H Acceptors6
H Donors1
TotalSurfaceArea333.6
Relative PSA0.19224
PolarSurfaceArea75.71
Druglikeness4.5759
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functionstwice activated DB
Shape Index0.59375
Fragments1
Non HAtoms32
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Symmetricatoms4
Amides2
StereoCon

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