[2-[(Z)-[[9-[(2Z)-2-[(2-benzoyloxyphenyl)methylidene]hydrazinyl]-9-oxononanoyl]hydrazinylidene]methyl]phenyl] benzoate

Formula:C37H36N4O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-[(Z)-[[9-[(2Z)-2-[(2-benzoyloxyphenyl)methylidene]hydrazinyl]-9-oxononanoyl]hydrazinylidene]methyl]phenyl] benzoate is not a drug-like molecule.

MolName[2-[(Z)-[[9-[(2Z)-2-[(2-benzoyloxyphenyl)methylidene]hydrazinyl]-9-oxononanoyl]hydrazinylidene]methyl]phenyl] benzoate
MolecularFormulaC37H36N4O6
SmilesO=C(CCCCCCCC(N/N=C\c(cccc1)c1OC(c1ccccc1)=O)=O)N/N=C\c(cccc1)c1OC(c1ccccc1)=O
InChIInChI=1S/C37H36N4O6/c42-34(40-38-26-30-20-12-14-22-32(30)46-36(44)28-16-6-4-7-17-28)24-10-2-1-3-11-25-35(43)41-39-27-31-21-13-15-23-33(31)47-37(45)29-18-8-5-9-19-29/h4-9,12-23,26-27H,1-3,10-11,24-25H2,(H,40,42)(H,41,43)
InChIKSBKYCAJQDLRUKP-UHFFFAOYSA-N
TotalMolweight632.715
Molweight632.715
MonoisotopicMass632.263486
CLogP8.5802
CLogS-8.948
H Acceptors10
H Donors2
TotalSurfaceArea512.3
Relative PSA0.23053
PolarSurfaceArea135.52
Druglikeness-4.422
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.65957
Fragments1
Non HAtoms47
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond18
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms9
Symmetricatoms25
StereoCon

Request More Details | [2-[(Z)-[[9-[(2Z)-2-[(2-benzoyloxyphenyl)methylidene]hydrazinyl]-9-oxononanoyl]hydrazinylidene]methyl]phenyl] benzoate


SKU Product Name Product Unit Qty Supplier Email
User Name
User Email
Additional Comments