6-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-3-[4-(2-methoxyethoxy)phenyl]-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
6-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-3-[4-(2-methoxyethoxy)phenyl]-1,2,4-triazin-5(2H)-one
6-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-3-[4-(2-methoxyethoxy)phenyl]-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | V023-1180 |
| Compound Name: | 6-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-3-[4-(2-methoxyethoxy)phenyl]-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 434.49 |
| Molecular Formula: | C24 H26 N4 O4 |
| Salt: | not_available |
| Smiles: | COCCOc1ccc(cc1)C1NN=C(CCC(N2CCc3ccccc3C2)=O)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9905 |
| logD: | 1.0493 |
| logSw: | -2.4193 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.123 |
| InChI Key: | IAMKUQHJRCXUGM-UHFFFAOYSA-N |