(3,4-dihydroisoquinolin-2(1H)-yl)[1-({(2S)-1-[(pyridin-4-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-4-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazol-4-yl]methanone
(3,4-dihydroisoquinolin-2(1H)-yl)[1-({(2S)-1-[(pyridin-4-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazol-4-yl]methanone
Compound characteristics
| Compound ID: | SB20-1097 |
| Compound Name: | (3,4-dihydroisoquinolin-2(1H)-yl)[1-({(2S)-1-[(pyridin-4-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)Cc1ccncc1 |
| Stereo: | ABSOLUTE |
| logP: | 1.8137 |
| logD: | 1.7892 |
| logSw: | -1.6368 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.401 |
| InChI Key: | SPTOFHACWQFEBU-NRFANRHFSA-N |