(3,4-dihydroisoquinolin-2(1H)-yl)(1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidin-3-yl)methanone
Chemical Structure Depiction of
(3,4-dihydroisoquinolin-2(1H)-yl)(1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidin-3-yl)methanone
(3,4-dihydroisoquinolin-2(1H)-yl)(1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidin-3-yl)methanone
Compound characteristics
| Compound ID: | F061-0938 |
| Compound Name: | (3,4-dihydroisoquinolin-2(1H)-yl)(1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidin-3-yl)methanone |
| Molecular Weight: | 509.6 |
| Molecular Formula: | C27 H28 F N3 O4 S |
| Smiles: | Cc1c(c(/C=C/c2ccccc2F)on1)S(N1CCCC(C1)C(N1CCc2ccccc2C1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9492 |
| logD: | 3.9492 |
| logSw: | -3.9104 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.709 |
| InChI Key: | WWNRSIJDFRTYKP-QHCPKHFHSA-N |