[4-[(Z)-[[2-[(4-chlorophenyl)methoxy]benzoyl]hydrazinylidene]methyl]phenyl] 2-fluorobenzoate

Formula:C28H20N2O4ClF Mutagenic:none Tumorigenic:none Reproductive Effective:none [4-[(Z)-[[2-[(4-chlorophenyl)methoxy]benzoyl]hydrazinylidene]methyl]phenyl] 2-fluorobenzoate is not a drug-like molecule.

MolName[4-[(Z)-[[2-[(4-chlorophenyl)methoxy]benzoyl]hydrazinylidene]methyl]phenyl] 2-fluorobenzoate
MolecularFormulaC28H20N2O4ClF
SmilesO=C(c(cccc1)c1OCc(cc1)ccc1Cl)N/N=C\c(cc1)ccc1OC(c(cccc1)c1F)=O
InChIInChI=1S/C28H20ClFN2O4/c29-21-13-9-20(10-14-21)18-35-26-8-4-2-6-24(26)27(33)32-31-17-19-11-15-22(16-12-19)36-28(34)23-5-1-3-7-25(23)30/h1-17H,18H2,(H,32,33)
InChIKIYTDLZDLUAPXNV-UHFFFAOYSA-N
TotalMolweight502.928
Molweight502.928
MonoisotopicMass502.109563
CLogP6.687
CLogS-7.582
H Acceptors6
H Donors1
TotalSurfaceArea379.79
Relative PSA0.18181
PolarSurfaceArea76.99
Druglikeness2.4981
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.63889
Fragments1
Non HAtoms36
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond9
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms3
Symmetricatoms4
StereoCon

Request More Details | [4-[(Z)-[[2-[(4-chlorophenyl)methoxy]benzoyl]hydrazinylidene]methyl]phenyl] 2-fluorobenzoate


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