2-[benzyl-[2-[(Z)-benzylideneamino]oxyacetyl]amino]benzoate
Formula:C23H19N2O4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[benzyl-[2-[(Z)-benzylideneamino]oxyacetyl]amino]benzoate is a drug-like molecule.
| MolName | 2-[benzyl-[2-[(Z)-benzylideneamino]oxyacetyl]amino]benzoate |
| MolecularFormula | C23H19N2O4 |
| Smiles | [O-]C(c(cccc1)c1N(Cc1ccccc1)C(CO/N=C\c1ccccc1)=O)=O |
| InChI | InChI=1S/C23H20N2O4/c26-22(17-29-24-15-18-9-3-1-4-10-18)25(16-19-11-5-2-6-12-19)21-14-8-7-13-20(21)23(27)28/h1-15H,16-17H2,(H,27,28)/p-1 |
| InChIK | ZJERHAURSIOVLG-UHFFFAOYSA-M |
| TotalMolweight | 387.414 |
| Molweight | 387.414 |
| MonoisotopicMass | 387.134483 |
| CLogP | 2.2866 |
| CLogS | -4.905 |
| H Acceptors | 6 |
| TotalSurfaceArea | 308.39 |
| Relative PSA | 0.21213 |
| PolarSurfaceArea | 82.03 |
| Druglikeness | 3.974 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.51724 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 8 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 4 |
| Amides | 1 |
| AcidicOxygens | 1 |
| StereoCon |
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1 - 2-[benzyl-[2-[(Z)-benzylideneamino]oxyacetyl]amino]benzoate | 2 - 2-[benzyl-[2-[(Z)-benzylideneamino]oxyacetyl]amino]benzoate
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