1-tert-butyl-4-{1-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl}pyrrolidin-2-one
Chemical Structure Depiction of
1-tert-butyl-4-{1-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl}pyrrolidin-2-one
1-tert-butyl-4-{1-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl}pyrrolidin-2-one
Compound characteristics
| Compound ID: | D510-1242 |
| Compound Name: | 1-tert-butyl-4-{1-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl}pyrrolidin-2-one |
| Molecular Weight: | 455.98 |
| Molecular Formula: | C25 H30 Cl N3 O3 |
| Smiles: | Cc1cc(ccc1[Cl])OCC(Cn1c2ccccc2nc1C1CC(N(C1)C(C)(C)C)=O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2074 |
| logD: | 5.2074 |
| logSw: | -5.4728 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.731 |
| InChI Key: | KEQDMERUVVPFNF-UHFFFAOYSA-N |