methyl 4-[6,7-dimethoxy-1-(4-methoxyphenyl)-3-oxo-3,4-dihydroisoquinolin-2(1H)-yl]benzoate
Chemical Structure Depiction of
methyl 4-[6,7-dimethoxy-1-(4-methoxyphenyl)-3-oxo-3,4-dihydroisoquinolin-2(1H)-yl]benzoate
methyl 4-[6,7-dimethoxy-1-(4-methoxyphenyl)-3-oxo-3,4-dihydroisoquinolin-2(1H)-yl]benzoate
Compound characteristics
| Compound ID: | D145-0465 |
| Compound Name: | methyl 4-[6,7-dimethoxy-1-(4-methoxyphenyl)-3-oxo-3,4-dihydroisoquinolin-2(1H)-yl]benzoate |
| Molecular Weight: | 447.49 |
| Molecular Formula: | C26 H25 N O6 |
| Smiles: | COC(c1ccc(cc1)N1C(c2ccc(cc2)OC)c2cc(c(cc2CC1=O)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0546 |
| logD: | 4.0546 |
| logSw: | -4.3336 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.296 |
| InChI Key: | DTPLQTGPGZWYAT-VWLOTQADSA-N |