| MolName | N'-[(E)-[(E)-1,3-diphenylprop-2-enylidene]amino]-N-phenylbutanediamide |
| MolecularFormula | C25H23N3O2 |
| Smiles | O=C(CCC(N/N=C(\C=C\c1ccccc1)/c1ccccc1)=O)Nc1ccccc1 |
| InChI | InChI=1S/C25H23N3O2/c29-24(26-22-14-8-3-9-15-22)18-19-25(30)28-27-23(21-12-6-2-7-13-21)17-16-20-10-4-1-5-11-20/h1-17H,18-19H2,(H,26,29)(H,28,30) |
| InChIK | UXZFYTRXPQDXGT-UHFFFAOYSA-N |
| TotalMolweight | 397.477 |
| Molweight | 397.477 |
| MonoisotopicMass | 397.179027 |
| CLogP | 4.7636 |
| CLogS | -5.965 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 328.19 |
| Relative PSA | 0.18437 |
| PolarSurfaceArea | 70.56 |
| Druglikeness | 2.7245 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 8 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 6 |
| Amides | 1 |
| StereoCon |
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1 - N'-[(E)-[(E)-1,3-diphenylprop-2-enylidene]amino]-N-phenylbutanediamide | 2 - N'-[(E)-[(E)-1,3-diphenylprop-2-enylidene]amino]-N-phenylbutanediamide