N-[(Z)-[2,4-di(propan-2-yloxy)phenyl]methylideneamino]-2,4-dimethoxybenzamide

Formula:C22H28N2O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-[2,4-di(propan-2-yloxy)phenyl]methylideneamino]-2,4-dimethoxybenzamide is a drug-like molecule.

MolNameN-[(Z)-[2,4-di(propan-2-yloxy)phenyl]methylideneamino]-2,4-dimethoxybenzamide
MolecularFormulaC22H28N2O5
SmilesCC(C)Oc1cc(OC(C)C)c(/C=N\NC(c(ccc(OC)c2)c2OC)=O)cc1
InChIInChI=1S/C22H28N2O5/c1-14(2)28-18-8-7-16(20(12-18)29-15(3)4)13-23-24-22(25)19-10-9-17(26-5)11-21(19)27-6/h7-15H,1-6H3,(H,24,25)
InChIKHVAJJADUPRJSEM-UHFFFAOYSA-N
TotalMolweight400.473
Molweight400.473
MonoisotopicMass400.199823
CLogP4.4528
CLogS-5.149
H Acceptors7
H Donors1
TotalSurfaceArea325.55
Relative PSA0.23348
PolarSurfaceArea78.38
Druglikeness3.7294
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.58621
Fragments1
Non HAtoms29
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond9
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms12
Symmetricatoms2
StereoCon

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