1-(6,7-dimethoxy-1-phenyl-3,4-dihydroisoquinolin-2(1H)-yl)pent-4-en-1-one
Chemical Structure Depiction of
1-(6,7-dimethoxy-1-phenyl-3,4-dihydroisoquinolin-2(1H)-yl)pent-4-en-1-one
1-(6,7-dimethoxy-1-phenyl-3,4-dihydroisoquinolin-2(1H)-yl)pent-4-en-1-one
Compound characteristics
| Compound ID: | V019-6859 |
| Compound Name: | 1-(6,7-dimethoxy-1-phenyl-3,4-dihydroisoquinolin-2(1H)-yl)pent-4-en-1-one |
| Molecular Weight: | 351.44 |
| Molecular Formula: | C22 H25 N O3 |
| Smiles: | COc1cc2CCN(C(c3ccccc3)c2cc1OC)C(CCC=C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9198 |
| logD: | 3.9198 |
| logSw: | -3.9932 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.8663 |
| InChI Key: | SEHKXMSWROIOSK-QFIPXVFZSA-N |