(3,4-dihydroisoquinolin-2(1H)-yl)[1-({(2S)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazol-4-yl]methanone
Chemical Structure Depiction of
(3,4-dihydroisoquinolin-2(1H)-yl)[1-({(2S)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazol-4-yl]methanone
(3,4-dihydroisoquinolin-2(1H)-yl)[1-({(2S)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazol-4-yl]methanone
Compound characteristics
| Compound ID: | SB20-0826 |
| Compound Name: | (3,4-dihydroisoquinolin-2(1H)-yl)[1-({(2S)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazol-4-yl]methanone |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C23 H27 N5 O2 |
| Smiles: | Cc1ccc(CN2CCC[C@H]2Cn2cc(C(N3CCc4ccccc4C3)=O)nn2)o1 |
| Stereo: | ABSOLUTE |
| logP: | 2.9088 |
| logD: | 2.5391 |
| logSw: | -2.9187 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.235 |
| InChI Key: | HEJOBDBGYUFWJK-FQEVSTJZSA-N |