N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine
Compound characteristics
| Compound ID: | C749-0214 |
| Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine |
| Molecular Weight: | 350.42 |
| Molecular Formula: | C20 H22 N4 O2 |
| Smiles: | COc1ccc(cc1)c1nc(NCCN2CCc3ccccc3C2)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.9581 |
| logD: | 3.0446 |
| logSw: | -4.0421 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.493 |
| InChI Key: | CYAFZZREIUCYHR-UHFFFAOYSA-N |