N-[(2-bromophenyl)methyl]-2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide
Chemical Structure Depiction of
N-[(2-bromophenyl)methyl]-2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide
N-[(2-bromophenyl)methyl]-2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide
Compound characteristics
| Compound ID: | P194-1337 |
| Compound Name: | N-[(2-bromophenyl)methyl]-2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide |
| Molecular Weight: | 467.36 |
| Molecular Formula: | C23 H23 Br N4 O2 |
| Smiles: | CC1=CC(N(CC(NCc2ccccc2[Br])=O)C(=N1)N1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4541 |
| logD: | 3.4541 |
| logSw: | -3.4855 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.089 |
| InChI Key: | SMBYMDPUIMAXQE-UHFFFAOYSA-N |