N-(4-bromo-2-methylphenyl)-3-(4-methoxyphenyl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-3-(4-methoxyphenyl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-(4-bromo-2-methylphenyl)-3-(4-methoxyphenyl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C096-1141 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-3-(4-methoxyphenyl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 479.37 |
| Molecular Formula: | C25 H23 Br N2 O3 |
| Smiles: | Cc1cc(ccc1NC(C1C(c2ccc(cc2)OC)N(C)C(c2ccccc12)=O)=O)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7717 |
| logD: | 4.7616 |
| logSw: | -4.5563 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.626 |
| InChI Key: | HCWVRVVBHGFYBY-UHFFFAOYSA-N |