2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[5-(2,4-dimethoxyphenyl)-3-(3,4-dimethoxyphenyl)-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-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[5-(2,4-dimethoxyphenyl)-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V019-5553 |
| Compound Name: | 2-(3,4-dihydroisoquinolin-2(1H)-yl)-1-[5-(2,4-dimethoxyphenyl)-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 515.61 |
| Molecular Formula: | C30 H33 N3 O5 |
| Salt: | not_available |
| Smiles: | COc1ccc(C2CC(c3ccc(c(c3)OC)OC)=NN2C(CN2CCc3ccccc3C2)=O)c(c1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7041 |
| logD: | 4.694 |
| logSw: | -4.3954 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.688 |
| InChI Key: | XIPNBBPOXGHURN-SANMLTNESA-N |