[4-[(Z)-[[2-[(4-chlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 4-nitrobenzoate

Formula:C23H17N4O6Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none [4-[(Z)-[[2-[(4-chlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 4-nitrobenzoate is a drug-like molecule.

MolName[4-[(Z)-[[2-[(4-chlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 4-nitrobenzoate
MolecularFormulaC23H17N4O6Cl
Smiles[O-][N+](c(cc1)ccc1C(Oc1ccc(/C=N\NC(CNC(c(cc2)ccc2Cl)=O)=O)cc1)=O)=O
InChIInChI=1S/C23H17ClN4O6/c24-18-7-3-16(4-8-18)22(30)25-14-21(29)27-26-13-15-1-11-20(12-2-15)34-23(31)17-5-9-19(10-6-17)28(32)33/h1-13H,14H2,(H,25,30)(H,27,29)
InChIKOYGQIRXPKDEZOH-UHFFFAOYSA-N
TotalMolweight480.863
Molweight480.863
MonoisotopicMass480.083663
CLogP3.4002
CLogS-6.154
H Acceptors10
H Donors2
TotalSurfaceArea356.56
Relative PSA0.31964
PolarSurfaceArea142.68
Druglikeness0.072954
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsaromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.70588
Fragments1
Non HAtoms34
NonCHAtoms11
Electronegative Atoms11
Rotatable Bond9
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms3
Symmetricatoms6
Amides1
AcidicOxygens1
StereoCon

Request More Details | [4-[(Z)-[[2-[(4-chlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 4-nitrobenzoate


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