N-[(4-bromophenyl)methyl]-2-ethyl-3-oxo-1,2,3,4-tetrahydroisoquinoline-1-carboxamide
Chemical Structure Depiction of
N-[(4-bromophenyl)methyl]-2-ethyl-3-oxo-1,2,3,4-tetrahydroisoquinoline-1-carboxamide
N-[(4-bromophenyl)methyl]-2-ethyl-3-oxo-1,2,3,4-tetrahydroisoquinoline-1-carboxamide
Compound characteristics
| Compound ID: | M575-0171 |
| Compound Name: | N-[(4-bromophenyl)methyl]-2-ethyl-3-oxo-1,2,3,4-tetrahydroisoquinoline-1-carboxamide |
| Molecular Weight: | 387.27 |
| Molecular Formula: | C19 H19 Br N2 O2 |
| Smiles: | CCN1C(C(NCc2ccc(cc2)[Br])=O)c2ccccc2CC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2576 |
| logD: | 3.2576 |
| logSw: | -3.1418 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.61 |
| InChI Key: | PBAYAEUKUOTMNJ-GOSISDBHSA-N |