2-[(3E)-3-(diphenylhydrazinylidene)-2-oxoindol-1-yl]-N-phenylacetamide
Formula:C28H22N4O2
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
2-[(3E)-3-(diphenylhydrazinylidene)-2-oxoindol-1-yl]-N-phenylacetamide is not a drug-like molecule.
| MolName | 2-[(3E)-3-(diphenylhydrazinylidene)-2-oxoindol-1-yl]-N-phenylacetamide |
| MolecularFormula | C28H22N4O2 |
| Smiles | O=C(CN(c(cccc1)c1/C1=N\N(c2ccccc2)c2ccccc2)C1=O)Nc1ccccc1 |
| InChI | InChI=1S/C28H22N4O2/c33-26(29-21-12-4-1-5-13-21)20-31-25-19-11-10-18-24(25)27(28(31)34)30-32(22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-19H,20H2,(H,29,33) |
| InChIK | UJXDQBVNPONBFQ-UHFFFAOYSA-N |
| TotalMolweight | 446.509 |
| Molweight | 446.509 |
| MonoisotopicMass | 446.174276 |
| CLogP | 5.0047 |
| CLogS | -7.224 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 343.33 |
| Relative PSA | 0.16355 |
| PolarSurfaceArea | 65.01 |
| Druglikeness | 6.5214 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.47059 |
| Fragments | 1 |
| Non HAtoms | 34 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Sp3Atoms | 1 |
| Symmetricatoms | 10 |
| Amides | 2 |
| StereoCon |
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