(2H-1,3-benzodioxol-5-yl){6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}methanone
Chemical Structure Depiction of
(2H-1,3-benzodioxol-5-yl){6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}methanone
(2H-1,3-benzodioxol-5-yl){6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}methanone
Compound characteristics
| Compound ID: | K407-0153 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl){6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}methanone |
| Molecular Weight: | 477.51 |
| Molecular Formula: | C27 H27 N O7 |
| Smiles: | COc1ccc(cc1)OCC1c2cc(c(cc2CCN1C(c1ccc2c(c1)OCO2)=O)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9938 |
| logD: | 3.9938 |
| logSw: | -4.1731 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.233 |
| InChI Key: | KFNIOSQFMRTNAC-QFIPXVFZSA-N |