N-[(Z)-(2-bromo-5-phenylmethoxyphenyl)methylideneamino]-2-phenylmethoxybenzamide
Formula:C28H23N2O3Br
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(2-bromo-5-phenylmethoxyphenyl)methylideneamino]-2-phenylmethoxybenzamide is not a drug-like molecule.
| MolName | N-[(Z)-(2-bromo-5-phenylmethoxyphenyl)methylideneamino]-2-phenylmethoxybenzamide |
| MolecularFormula | C28H23N2O3Br |
| Smiles | O=C(c(cccc1)c1OCc1ccccc1)N/N=C\c(cc(cc1)OCc2ccccc2)c1Br |
| InChI | InChI=1S/C28H23BrN2O3/c29-26-16-15-24(33-19-21-9-3-1-4-10-21)17-23(26)18-30-31-28(32)25-13-7-8-14-27(25)34-20-22-11-5-2-6-12-22/h1-18H,19-20H2,(H,31,32) |
| InChIK | GIFBPOSEOHNERP-UHFFFAOYSA-N |
| TotalMolweight | 515.406 |
| Molweight | 515.406 |
| MonoisotopicMass | 514.089204 |
| CLogP | 6.623 |
| CLogS | -7.237 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 372.66 |
| Relative PSA | 0.1503 |
| PolarSurfaceArea | 59.92 |
| Druglikeness | 2.2305 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.61765 |
| Fragments | 1 |
| Non HAtoms | 34 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 9 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Sp3Atoms | 4 |
| Symmetricatoms | 4 |
| StereoCon |
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1 - N-[(Z)-(2-bromo-5-phenylmethoxyphenyl)methylideneamino]-2-phenylmethoxybenzamide | 2 - N-[(Z)-(2-bromo-5-phenylmethoxyphenyl)methylideneamino]-2-phenylmethoxybenzamide
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