(3,4-dihydroisoquinolin-2(1H)-yl)[5-(4-methoxyphenyl)-1-phenyl-1H-1,2,4-triazol-3-yl]methanone
Chemical Structure Depiction of
(3,4-dihydroisoquinolin-2(1H)-yl)[5-(4-methoxyphenyl)-1-phenyl-1H-1,2,4-triazol-3-yl]methanone
(3,4-dihydroisoquinolin-2(1H)-yl)[5-(4-methoxyphenyl)-1-phenyl-1H-1,2,4-triazol-3-yl]methanone
Compound characteristics
| Compound ID: | D351-2621 |
| Compound Name: | (3,4-dihydroisoquinolin-2(1H)-yl)[5-(4-methoxyphenyl)-1-phenyl-1H-1,2,4-triazol-3-yl]methanone |
| Molecular Weight: | 410.47 |
| Molecular Formula: | C25 H22 N4 O2 |
| Smiles: | COc1ccc(cc1)c1nc(C(N2CCc3ccccc3C2)=O)nn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8327 |
| logD: | 4.8327 |
| logSw: | -4.6012 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.743 |
| InChI Key: | OBHWZTRKLPEIDW-UHFFFAOYSA-N |