1-(3,4-dihydroquinolin-1(2H)-yl)-2-({1-[(4-fluorophenyl)methyl]-5-(hydroxymethyl)-1H-imidazol-2-yl}sulfanyl)ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroquinolin-1(2H)-yl)-2-({1-[(4-fluorophenyl)methyl]-5-(hydroxymethyl)-1H-imidazol-2-yl}sulfanyl)ethan-1-one
1-(3,4-dihydroquinolin-1(2H)-yl)-2-({1-[(4-fluorophenyl)methyl]-5-(hydroxymethyl)-1H-imidazol-2-yl}sulfanyl)ethan-1-one
Compound characteristics
| Compound ID: | G621-0281 |
| Compound Name: | 1-(3,4-dihydroquinolin-1(2H)-yl)-2-({1-[(4-fluorophenyl)methyl]-5-(hydroxymethyl)-1H-imidazol-2-yl}sulfanyl)ethan-1-one |
| Molecular Weight: | 411.5 |
| Molecular Formula: | C22 H22 F N3 O2 S |
| Smiles: | C1Cc2ccccc2N(C1)C(CSc1ncc(CO)n1Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4952 |
| logD: | 3.4947 |
| logSw: | -3.4583 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.416 |
| InChI Key: | JUMSHGLXWQGXJC-UHFFFAOYSA-N |