methyl {2-[(3-chloro-4-methylphenyl)carbamoyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate
Chemical Structure Depiction of
methyl {2-[(3-chloro-4-methylphenyl)carbamoyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate
methyl {2-[(3-chloro-4-methylphenyl)carbamoyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate
Compound characteristics
| Compound ID: | G525-0093 |
| Compound Name: | methyl {2-[(3-chloro-4-methylphenyl)carbamoyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate |
| Molecular Weight: | 432.9 |
| Molecular Formula: | C22 H25 Cl N2 O5 |
| Smiles: | Cc1ccc(cc1[Cl])NC(N1CCc2cc(c(cc2C1CC(=O)OC)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9256 |
| logD: | 3.9256 |
| logSw: | -4.3062 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.746 |
| InChI Key: | PDBAIKXNIBKLMB-SFHVURJKSA-N |