N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-[2-(4-methoxyphenyl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-[2-(4-methoxyphenyl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-[2-(4-methoxyphenyl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
Compound characteristics
| Compound ID: | E016-0235 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-[2-(4-methoxyphenyl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide |
| Molecular Weight: | 472.55 |
| Molecular Formula: | C26 H28 N6 O3 |
| Smiles: | COc1ccc(cc1)c1cc2C(N(CC(NCCCN3CCc4ccccc4C3)=O)N=Cn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1652 |
| logD: | 0.9611 |
| logSw: | -2.8229 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.646 |
| InChI Key: | MNGNMCHEISGVOX-UHFFFAOYSA-N |