2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[5-(3-fluorophenyl)-3-(2-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[5-(3-fluorophenyl)-3-(2-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[5-(3-fluorophenyl)-3-(2-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V002-2190 |
| Compound Name: | 2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[5-(3-fluorophenyl)-3-(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(c2cccc(c2)F)N(C(CN2CCc3ccccc3C2)=O)N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8279 |
| logD: | 4.8178 |
| logSw: | -4.6541 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.884 |
| InChI Key: | RYQKUCXFNDVJGH-VWLOTQADSA-N |