N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G637-1158 |
| Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide |
| Molecular Weight: | 552.67 |
| Molecular Formula: | C29 H33 F N4 O4 S |
| Smiles: | Cc1c(c(/C=C/c2ccccc2F)on1)S(N1CCC(CC1)C(NCCN1CCc2ccccc2C1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6612 |
| logD: | 3.1687 |
| logSw: | -3.7399 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.364 |
| InChI Key: | VOIDHOLQKBJVJP-UHFFFAOYSA-N |