2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[3-(4-fluorophenyl)-5-(2-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[3-(4-fluorophenyl)-5-(2-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[3-(4-fluorophenyl)-5-(2-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V002-2139 |
| Compound Name: | 2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[3-(4-fluorophenyl)-5-(2-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C27 H26 F N3 O2 |
| Salt: | not_available |
| Smiles: | COc1ccccc1C1CC(c2ccc(cc2)F)=NN1C(CN1CCc2ccccc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1803 |
| logD: | 5.1702 |
| logSw: | -5.0957 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.884 |
| InChI Key: | NRJURFZFJRYGGX-RUZDIDTESA-N |