3-[2-(1H-benzimidazol-2-yl)ethyl]-5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-(2-methoxyphenyl)-3,5-dihydro-4H-imidazol-4-one
Chemical Structure Depiction of
3-[2-(1H-benzimidazol-2-yl)ethyl]-5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-(2-methoxyphenyl)-3,5-dihydro-4H-imidazol-4-one
3-[2-(1H-benzimidazol-2-yl)ethyl]-5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-(2-methoxyphenyl)-3,5-dihydro-4H-imidazol-4-one
Compound characteristics
| Compound ID: | 8017-8774 |
| Compound Name: | 3-[2-(1H-benzimidazol-2-yl)ethyl]-5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-(2-methoxyphenyl)-3,5-dihydro-4H-imidazol-4-one |
| Molecular Weight: | 466.5 |
| Molecular Formula: | C27 H22 N4 O4 |
| Smiles: | COc1ccccc1C1=NC(=C/c2ccc3c(c2)OCO3)\C(N1CCc1nc2ccccc2[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5363 |
| logD: | 4.5362 |
| logSw: | -4.3516 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.546 |
| InChI Key: | QMHBNXMGGUFYQT-UHFFFAOYSA-N |