4-{1-[2-(4-methoxyphenoxy)ethyl]-1H-benzimidazol-2-yl}-1-[3-(methylsulfanyl)phenyl]pyrrolidin-2-one
Chemical Structure Depiction of
4-{1-[2-(4-methoxyphenoxy)ethyl]-1H-benzimidazol-2-yl}-1-[3-(methylsulfanyl)phenyl]pyrrolidin-2-one
4-{1-[2-(4-methoxyphenoxy)ethyl]-1H-benzimidazol-2-yl}-1-[3-(methylsulfanyl)phenyl]pyrrolidin-2-one
Compound characteristics
| Compound ID: | C630-0495 |
| Compound Name: | 4-{1-[2-(4-methoxyphenoxy)ethyl]-1H-benzimidazol-2-yl}-1-[3-(methylsulfanyl)phenyl]pyrrolidin-2-one |
| Molecular Weight: | 473.59 |
| Molecular Formula: | C27 H27 N3 O3 S |
| Smiles: | COc1ccc(cc1)OCCn1c2ccccc2nc1C1CC(N(C1)c1cccc(c1)SC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3513 |
| logD: | 5.3513 |
| logSw: | -5.2434 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.585 |
| InChI Key: | PEHSHMLCKGKMDW-LJQANCHMSA-N |