(3,4-dihydroisoquinolin-2(1H)-yl)[1-({(2S)-1-[(pyridin-3-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-[(pyridin-3-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazol-4-yl]methanone
(3,4-dihydroisoquinolin-2(1H)-yl)[1-({(2S)-1-[(pyridin-3-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazol-4-yl]methanone
Compound characteristics
| Compound ID: | SB20-0801 |
| Compound Name: | (3,4-dihydroisoquinolin-2(1H)-yl)[1-({(2S)-1-[(pyridin-3-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazol-4-yl]methanone |
| Molecular Weight: | 402.5 |
| Molecular Formula: | C23 H26 N6 O |
| Smiles: | C1C[C@@H](Cn2cc(C(N3CCc4ccccc4C3)=O)nn2)N(C1)Cc1cccnc1 |
| Stereo: | ABSOLUTE |
| logP: | 1.857 |
| logD: | 1.8186 |
| logSw: | -1.4108 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.49 |
| InChI Key: | GCVUZJLHMOLCFA-NRFANRHFSA-N |