{2-[(4-bromo-3-methylphenyl)carbamoyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}acetic acid
Chemical Structure Depiction of
{2-[(4-bromo-3-methylphenyl)carbamoyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}acetic acid
{2-[(4-bromo-3-methylphenyl)carbamoyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}acetic acid
Compound characteristics
| Compound ID: | G526-0218 |
| Compound Name: | {2-[(4-bromo-3-methylphenyl)carbamoyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}acetic acid |
| Molecular Weight: | 403.27 |
| Molecular Formula: | C19 H19 Br N2 O3 |
| Smiles: | Cc1cc(ccc1[Br])NC(N1CCc2ccccc2C1CC(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8665 |
| logD: | 1.2287 |
| logSw: | -3.9611 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.29 |
| InChI Key: | MZUPKAWHXOSKTC-KRWDZBQOSA-N |