4-bromo-N-[(Z)-(3,4-dichlorophenyl)methylideneamino]benzamide
Molecular Formula : C14H9N2OBrCl2 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |4-bromo-N-[(Z)-(3,4-dichlorophenyl)methylideneamino]benzamide is not a drug-like molecule.
MolName : 4-bromo-N-[(Z)-(3,4-dichlorophenyl)methylideneamino]benzamide |
MolecularFormula : C14H9N2OBrCl2 |
Smiles : O=C(c(cc1)ccc1Br)N/N=C\c(cc1)cc(Cl)c1Cl |
InChI : InChI=1S/C14H9BrCl2N2O/c15-11-4-2-10(3-5-11)14(20)19-18-8-9-1-6-12(16)13(17)7-9/h1-8H,(H,19,20) |
InChIK : WGNFQCROLHPUAC-UHFFFAOYSA-N |
TotalMolweight : 372.048 |
Molweight : 372.048 |
MonoisotopicMass : 369.927528 |
CLogP : 5.1388 |
CLogS : -6.027 |
H Acceptors : 3 |
H Donors : 1 |
TotalSurfaceArea : 236.46 |
Relative PSA : 0.15229 |
PolarSurfaceArea : 41.46 |
Druglikeness : 2.6815 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : acyl-hydrazone; imine/hydrazone of aldehyde |
Shape Index : 0.7 |
Fragments : 1 |
Non HAtoms : 20 |
NonCHAtoms : 6 |
Electronegative Atoms : 6 |
Rotatable Bond : 3 |
Rings Closures : 2 |
Small Rings : 2 |
Aromatic Rings : 2 |
Aromatic Atoms : 12 |
Symmetricatoms : 2 |
StereoCon : |