(3,4-dihydroisoquinolin-2(1H)-yl)(1-{[(2S)-1-(1-methylpiperidin-4-yl)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-(1-methylpiperidin-4-yl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)methanone
(3,4-dihydroisoquinolin-2(1H)-yl)(1-{[(2S)-1-(1-methylpiperidin-4-yl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)methanone
Compound characteristics
| Compound ID: | SB20-1076 |
| Compound Name: | (3,4-dihydroisoquinolin-2(1H)-yl)(1-{[(2S)-1-(1-methylpiperidin-4-yl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)methanone |
| Molecular Weight: | 408.55 |
| Molecular Formula: | C23 H32 N6 O |
| Smiles: | CN1CCC(CC1)N1CCC[C@H]1Cn1cc(C(N2CCc3ccccc3C2)=O)nn1 |
| Stereo: | ABSOLUTE |
| logP: | 1.9577 |
| logD: | 0.2975 |
| logSw: | -2.0897 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.836 |
| InChI Key: | UCNNKUAGTIZRMO-NRFANRHFSA-N |