1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]ethan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]ethan-1-one
Compound characteristics
| Compound ID: | Y043-5214 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]ethan-1-one |
| Molecular Weight: | 349.39 |
| Molecular Formula: | C19 H19 N5 O2 |
| Smiles: | Cn1nc(c2ccc(cc2)OCC(N2CCc3ccccc3C2)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 2.0678 |
| logD: | 2.0678 |
| logSw: | -2.4085 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.657 |
| InChI Key: | BKMUHAFEIVPCOK-UHFFFAOYSA-N |