1-tert-butyl-4-{1-[2-hydroxy-3-(2-methylphenoxy)propyl]-1H-benzimidazol-2-yl}pyrrolidin-2-one
Chemical Structure Depiction of
1-tert-butyl-4-{1-[2-hydroxy-3-(2-methylphenoxy)propyl]-1H-benzimidazol-2-yl}pyrrolidin-2-one
1-tert-butyl-4-{1-[2-hydroxy-3-(2-methylphenoxy)propyl]-1H-benzimidazol-2-yl}pyrrolidin-2-one
Compound characteristics
| Compound ID: | D510-1232 |
| Compound Name: | 1-tert-butyl-4-{1-[2-hydroxy-3-(2-methylphenoxy)propyl]-1H-benzimidazol-2-yl}pyrrolidin-2-one |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C25 H31 N3 O3 |
| Smiles: | Cc1ccccc1OCC(Cn1c2ccccc2nc1C1CC(N(C1)C(C)(C)C)=O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5271 |
| logD: | 4.5271 |
| logSw: | -4.4396 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.818 |
| InChI Key: | KXZWYERJTYZDCI-UHFFFAOYSA-N |