2,2-bis(4-chlorophenoxy)-N-[(Z)-[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methylideneamino]acetamide

Formula:C32H23N2O4Cl2F Mutagenic:high Tumorigenic:high Reproductive Effective:high 2,2-bis(4-chlorophenoxy)-N-[(Z)-[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methylideneamino]acetamide is not a drug-like molecule.

MolName2,2-bis(4-chlorophenoxy)-N-[(Z)-[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methylideneamino]acetamide
MolecularFormulaC32H23N2O4Cl2F
SmilesO=C(C(Oc(cc1)ccc1Cl)Oc(cc1)ccc1Cl)N/N=C\c(c1ccccc1cc1)c1OCc(cc1)ccc1F
InChIInChI=1S/C32H23Cl2FN2O4/c33-23-8-14-26(15-9-23)40-32(41-27-16-10-24(34)11-17-27)31(38)37-36-19-29-28-4-2-1-3-22(28)7-18-30(29)39-20-21-5-12-25(35)13-6-21/h1-19,32H,20H2,(H,37,38)
InChIKBRWVHMXIZAVKSI-UHFFFAOYSA-N
TotalMolweight589.449
Molweight589.449
MonoisotopicMass588.10189
CLogP7.8695
CLogS-9.505
H Acceptors6
H Donors1
TotalSurfaceArea434.56
Relative PSA0.1519
PolarSurfaceArea69.15
Druglikeness2.9922
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.4878
Fragments1
Non HAtoms41
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond10
Rings Closures5
Small Rings5
Aromatic Rings5
Aromatic Atoms28
Sp3Atoms5
Symmetricatoms12
StereoCon

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