N-(4-bromo-2-methylphenyl)-2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-(4-bromo-2-methylphenyl)-2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C080-0037 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 537.41 |
| Molecular Formula: | C27 H25 Br N2 O5 |
| Smiles: | CCOc1ccc(cc1)N1C=C(C(Nc2ccc(cc2C)[Br])=O)c2cc(c(cc2C1=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.1616 |
| logD: | 5.1534 |
| logSw: | -5.0039 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.532 |
| InChI Key: | PFNRTIJZLXICOU-UHFFFAOYSA-N |