| MolName | bis[4-[4-phenyl-2-[(E)-2-phenylethenyl]-1H-imidazol-5-yl]phenyl]methanone |
| MolecularFormula | C47H34N4O |
| Smiles | O=C(c(cc1)ccc1-c1c(-c2ccccc2)nc(/C=C/c2ccccc2)[nH]1)c(cc1)ccc1-c1c(-c2ccccc2)nc(/C=C/c2ccccc2)[nH]1 |
| InChI | InChI=1S/C47H34N4O/c52-47(39-27-23-37(24-28-39)45-43(35-17-9-3-10-18-35)48-41(50-45)31-21-33-13-5-1-6-14-33)40-29-25-38(26-30-40)46-44(36-19-11-4-12-20-36)49-42(51-46)32-22-34-15-7-2-8-16-34/h1-32H,(H,48,50)(H,49,51) |
| InChIK | ABNZOKONXSCTRO-UHFFFAOYSA-N |
| TotalMolweight | 670.814 |
| Molweight | 670.814 |
| MonoisotopicMass | 670.273261 |
| CLogP | 10.304 |
| CLogS | -11.298 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 538.99 |
| Relative PSA | 0.11681 |
| PolarSurfaceArea | 74.43 |
| Druglikeness | 1.3886 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.51923 |
| Fragments | 1 |
| Non HAtoms | 52 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 10 |
| Rings Closures | 8 |
| Small Rings | 8 |
| Aromatic Rings | 8 |
| Aromatic Atoms | 46 |
| Symmetricatoms | 31 |
| Aromatic Nitrogens | 4 |
| BasicNitrogens | 2 |
| StereoCon |
Click to Load Molecule:
1 - bis[4-[4-phenyl-2-[(E)-2-phenylethenyl]-1H-imidazol-5-yl]phenyl]methanone | 2 - bis[4-[4-phenyl-2-[(E)-2-phenylethenyl]-1H-imidazol-5-yl]phenyl]methanone