2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[3-(2,5-dimethylphenyl)-5-(3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[3-(2,5-dimethylphenyl)-5-(3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[3-(2,5-dimethylphenyl)-5-(3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V023-3342 |
| Compound Name: | 2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[3-(2,5-dimethylphenyl)-5-(3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 453.58 |
| Molecular Formula: | C29 H31 N3 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(C)c(c1)C1CC(c2cccc(c2)OC)N(C(CN2CCc3ccccc3C2)=O)N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7932 |
| logD: | 5.7831 |
| logSw: | -5.5032 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.797 |
| InChI Key: | PHRHTCBBORUWNE-NDEPHWFRSA-N |