2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[5-(2,4-dimethoxyphenyl)-3-(3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[5-(2,4-dimethoxyphenyl)-3-(3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[5-(2,4-dimethoxyphenyl)-3-(3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V002-2179 |
| Compound Name: | 2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[5-(2,4-dimethoxyphenyl)-3-(3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 485.58 |
| Molecular Formula: | C29 H31 N3 O4 |
| Smiles: | COc1cccc(c1)C1CC(c2ccc(cc2OC)OC)N(C(CN2CCc3ccccc3C2)=O)N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1421 |
| logD: | 5.132 |
| logSw: | -5.0492 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.971 |
| InChI Key: | VXEIOQSZSIUCMF-MHZLTWQESA-N |