N-[(Z)-(5-bromo-2-phenylmethoxyphenyl)methylideneamino]-2-hydroxy-2,2-diphenylacetamide
Formula:C28H23N2O3Br
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(5-bromo-2-phenylmethoxyphenyl)methylideneamino]-2-hydroxy-2,2-diphenylacetamide is not a drug-like molecule.
| MolName | N-[(Z)-(5-bromo-2-phenylmethoxyphenyl)methylideneamino]-2-hydroxy-2,2-diphenylacetamide |
| MolecularFormula | C28H23N2O3Br |
| Smiles | OC(C(N/N=C\c(cc(cc1)Br)c1OCc1ccccc1)=O)(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C28H23BrN2O3/c29-25-16-17-26(34-20-21-10-4-1-5-11-21)22(18-25)19-30-31-27(32)28(33,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-19,33H,20H2,(H,31,32) |
| InChIK | NVRFTWABLYZVBA-UHFFFAOYSA-N |
| TotalMolweight | 515.406 |
| Molweight | 515.406 |
| MonoisotopicMass | 514.089204 |
| CLogP | 5.5552 |
| CLogS | -6.602 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 365.66 |
| Relative PSA | 0.16165 |
| PolarSurfaceArea | 70.92 |
| Druglikeness | 3.3367 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 34 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 8 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Sp3Atoms | 4 |
| Symmetricatoms | 10 |
| StereoCon |
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