| MolName | methyl 4-[2-(2,2-diphenylacetyl)hydrazinyl]-4-oxobutanoate |
| MolecularFormula | C19H20N2O4 |
| Smiles | COC(CCC(NNC(C(c1ccccc1)c1ccccc1)=O)=O)=O |
| InChI | InChI=1S/C19H20N2O4/c1-25-17(23)13-12-16(22)20-21-19(24)18(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,18H,12-13H2,1H3,(H,20,22)(H,21,24) |
| InChIK | DANMIXGVNOHPCU-UHFFFAOYSA-N |
| TotalMolweight | 340.378 |
| Molweight | 340.378 |
| MonoisotopicMass | 340.142308 |
| CLogP | 1.7599 |
| CLogS | -3.397 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 271.47 |
| Relative PSA | 0.26537 |
| PolarSurfaceArea | 84.5 |
| Druglikeness | -6.2608 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.56 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 8 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 5 |
| Symmetricatoms | 8 |
| StereoCon |
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1 - methyl 4-[2-(2,2-diphenylacetyl)hydrazinyl]-4-oxobutanoate | 2 - methyl 4-[2-(2,2-diphenylacetyl)hydrazinyl]-4-oxobutanoate