4-{1-[3-(4-methoxyphenoxy)propyl]-1H-benzimidazol-2-yl}-1-[3-(methylsulfanyl)phenyl]pyrrolidin-2-one
Chemical Structure Depiction of
4-{1-[3-(4-methoxyphenoxy)propyl]-1H-benzimidazol-2-yl}-1-[3-(methylsulfanyl)phenyl]pyrrolidin-2-one
4-{1-[3-(4-methoxyphenoxy)propyl]-1H-benzimidazol-2-yl}-1-[3-(methylsulfanyl)phenyl]pyrrolidin-2-one
Compound characteristics
Compound ID: | C630-0498 |
Compound Name: | 4-{1-[3-(4-methoxyphenoxy)propyl]-1H-benzimidazol-2-yl}-1-[3-(methylsulfanyl)phenyl]pyrrolidin-2-one |
Molecular Weight: | 487.62 |
Molecular Formula: | C28 H29 N3 O3 S |
Smiles: | COc1ccc(cc1)OCCCn1c2ccccc2nc1C1CC(N(C1)c1cccc(c1)SC)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.574 |
logD: | 5.574 |
logSw: | -5.2639 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 41.585 |
InChI Key: | UYEYQJPKNITWHY-HXUWFJFHSA-N |