1-N,4-N-bis[(Z)-pyridin-4-ylmethylideneamino]benzene-1,4-dicarboxamide
Molecular Formula : C20H16N6O2 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |1-N,4-N-bis[(Z)-pyridin-4-ylmethylideneamino]benzene-1,4-dicarboxamide is a drug-like molecule.
MolName : 1-N,4-N-bis[(Z)-pyridin-4-ylmethylideneamino]benzene-1,4-dicarboxamide |
MolecularFormula : C20H16N6O2 |
Smiles : O=C(c(cc1)ccc1C(N/N=C\c1ccncc1)=O)N/N=C\c1ccncc1 |
InChI : InChI=1S/C20H16N6O2/c27-19(25-23-13-15-5-9-21-10-6-15)17-1-2-18(4-3-17)20(28)26-24-14-16-7-11-22-12-8-16/h1-14H,(H,25,27)(H,26,28) |
InChIK : NKGPTXFOXJECRP-UHFFFAOYSA-N |
TotalMolweight : 372.387 |
Molweight : 372.387 |
MonoisotopicMass : 372.133474 |
CLogP : 2.7418 |
CLogS : -4.236 |
H Acceptors : 8 |
H Donors : 2 |
TotalSurfaceArea : 298.24 |
Relative PSA : 0.31505 |
PolarSurfaceArea : 108.7 |
Druglikeness : 4.4687 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : acyl-hydrazone; imine/hydrazone of aldehyde |
Shape Index : 0.71429 |
Fragments : 1 |
Non HAtoms : 28 |
NonCHAtoms : 8 |
Electronegative Atoms : 8 |
Rotatable Bond : 6 |
Rings Closures : 3 |
Small Rings : 3 |
Aromatic Rings : 3 |
Aromatic Atoms : 18 |
Symmetricatoms : 17 |
Aromatic Nitrogens : 2 |
StereoCon : |