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(Z)-1-[(3E)-3-[(2,4-dichlorophenyl)methylidene]-2-morpholin-4-ylcyclopenten-1-yl]-N-[(Z)-[5-[4-(difluoromethylsulfanyl)phenyl]furan-2-yl]methylideneamino]methanimine

Formula:C29H25N3O2Cl2F2S Mutagenic:high Tumorigenic:high Reproductive Effective:none (Z)-1-[(3E)-3-[(2,4-dichlorophenyl)methylidene]-2-morpholin-4-ylcyclopenten-1-yl]-N-[(Z)-[5-[4-(difluoromethylsulfanyl)phenyl]furan-2-yl]methylideneamino]methanimine is not a drug-like molecule.
MolName(Z)-1-[(3E)-3-[(2,4-dichlorophenyl)methylidene]-2-morpholin-4-ylcyclopenten-1-yl]-N-[(Z)-[5-[4-(difluoromethylsulfanyl)phenyl]furan-2-yl]methylideneamino]methanimine
MolecularFormulaC29H25N3O2Cl2F2S
SmilesFC(F)Sc(cc1)ccc1-c1ccc(/C=N\N=C/C(CC/C2=C\c(ccc(Cl)c3)c3Cl)=C2N2CCOCC2)o1
InChIInChI=1S/C29H25Cl2F2N3O2S/c30-23-6-3-20(26(31)16-23)15-21-1-2-22(28(21)36-11-13-37-14-12-36)17-34-35-18-24-7-10-27(38-24)19-4-8-25(9-5-19)39-29(32)33/h3-10,15-18,29H,1-2,11-14H2
InChIKSGKAWNJVJIEDDE-UHFFFAOYSA-N
TotalMolweight588.505
Molweight588.505
MonoisotopicMass587.101257
CLogP9.4109
CLogS-9.099
H Acceptors5
TotalSurfaceArea429.01
Relative PSA0.1589
PolarSurfaceArea75.63
Druglikeness1.6442
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionsdimethylene-hydrazine; imine/hydrazone of aldehyde
Shape Index0.58974
Fragments1
Non HAtoms39
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond8
Rings Closures5
Small Rings5
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms9
Symmetricatoms5
StereoCon

Request More Details | (Z)-1-[(3E)-3-[(2,4-dichlorophenyl)methylidene]-2-morpholin-4-ylcyclopenten-1-yl]-N-[(Z)-[5-[4-(difluoromethylsulfanyl)phenyl]furan-2-yl]methylideneamino]methanimine


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