methyl {2-[(4-bromophenyl)carbamoyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate
Chemical Structure Depiction of
methyl {2-[(4-bromophenyl)carbamoyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate
methyl {2-[(4-bromophenyl)carbamoyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate
Compound characteristics
| Compound ID: | G525-0118 |
| Compound Name: | methyl {2-[(4-bromophenyl)carbamoyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate |
| Molecular Weight: | 463.33 |
| Molecular Formula: | C21 H23 Br N2 O5 |
| Smiles: | COC(CC1c2cc(c(cc2CCN1C(Nc1ccc(cc1)[Br])=O)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3693 |
| logD: | 3.3693 |
| logSw: | -3.5816 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.746 |
| InChI Key: | VGIVJWQQXWZBIT-KRWDZBQOSA-N |