methyl 2-[(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)amino]benzoate
methyl 2-[(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | Y044-0031 |
| Compound Name: | methyl 2-[(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)amino]benzoate |
| Molecular Weight: | 370.4 |
| Molecular Formula: | C20 H22 N2 O5 |
| Smiles: | COC(c1ccccc1NC(N1CCc2cc(c(cc2C1)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0574 |
| logD: | 3.056 |
| logSw: | -3.489 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.106 |
| InChI Key: | CQWTWAPSKGGJHL-UHFFFAOYSA-N |