4-{1-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl}-1-(3-methoxyphenyl)pyrrolidin-2-one
Chemical Structure Depiction of
4-{1-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl}-1-(3-methoxyphenyl)pyrrolidin-2-one
4-{1-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl}-1-(3-methoxyphenyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | D510-0970 |
| Compound Name: | 4-{1-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl}-1-(3-methoxyphenyl)pyrrolidin-2-one |
| Molecular Weight: | 485.58 |
| Molecular Formula: | C29 H31 N3 O4 |
| Smiles: | Cc1cccc(C)c1OCC(Cn1c2ccccc2nc1C1CC(N(C1)c1cccc(c1)OC)=O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5358 |
| logD: | 5.5357 |
| logSw: | -5.3197 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.481 |
| InChI Key: | NMQWCNYTXRRWPZ-UHFFFAOYSA-N |