2-[2-({2-[2-(prop-2-en-1-yl)phenoxy]ethyl}sulfanyl)-1H-benzimidazol-1-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[2-({2-[2-(prop-2-en-1-yl)phenoxy]ethyl}sulfanyl)-1H-benzimidazol-1-yl]-1-(pyrrolidin-1-yl)ethan-1-one
2-[2-({2-[2-(prop-2-en-1-yl)phenoxy]ethyl}sulfanyl)-1H-benzimidazol-1-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | D347-0284 |
| Compound Name: | 2-[2-({2-[2-(prop-2-en-1-yl)phenoxy]ethyl}sulfanyl)-1H-benzimidazol-1-yl]-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 421.56 |
| Molecular Formula: | C24 H27 N3 O2 S |
| Smiles: | C=CCc1ccccc1OCCSc1nc2ccccc2n1CC(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9417 |
| logD: | 4.9354 |
| logSw: | -4.8367 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.74 |
| InChI Key: | ZJPNFLNFGICEEH-UHFFFAOYSA-N |