N-(4-bromo-2-methylphenyl)-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-(4-bromo-2-methylphenyl)-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C096-0727 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 511.39 |
| Molecular Formula: | C26 H24 Br F N2 O3 |
| Smiles: | Cc1cc(ccc1NC(C1C(c2ccc(cc2)F)N(CCOC)C(c2ccccc12)=O)=O)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0578 |
| logD: | 5.0477 |
| logSw: | -4.591 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.637 |
| InChI Key: | DLTQAMVVKTWOMG-UHFFFAOYSA-N |