4-(1-{2-hydroxy-3-[4-(propan-2-yl)phenoxy]propyl}-1H-benzimidazol-2-yl)-1-(4-methylphenyl)pyrrolidin-2-one
Chemical Structure Depiction of
4-(1-{2-hydroxy-3-[4-(propan-2-yl)phenoxy]propyl}-1H-benzimidazol-2-yl)-1-(4-methylphenyl)pyrrolidin-2-one
4-(1-{2-hydroxy-3-[4-(propan-2-yl)phenoxy]propyl}-1H-benzimidazol-2-yl)-1-(4-methylphenyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | D510-1000 |
| Compound Name: | 4-(1-{2-hydroxy-3-[4-(propan-2-yl)phenoxy]propyl}-1H-benzimidazol-2-yl)-1-(4-methylphenyl)pyrrolidin-2-one |
| Molecular Weight: | 483.61 |
| Molecular Formula: | C30 H33 N3 O3 |
| Smiles: | CC(C)c1ccc(cc1)OCC(Cn1c2ccccc2nc1C1CC(N(C1)c1ccc(C)cc1)=O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.2558 |
| logD: | 6.2558 |
| logSw: | -5.4794 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.764 |
| InChI Key: | IRYIGIXFSORAIQ-UHFFFAOYSA-N |