N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | S397-0109 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 354.45 |
| Molecular Formula: | C20 H26 N4 O2 |
| Smiles: | Cn1c2CCOCc2c(C(NCCCN2CCc3ccccc3C2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.1167 |
| logD: | -0.0332 |
| logSw: | -2.0984 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.483 |
| InChI Key: | CNNPXILRRILVRX-UHFFFAOYSA-N |