N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-ethyl-N-(oxan-4-yl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-ethyl-N-(oxan-4-yl)-1H-pyrazole-3-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-ethyl-N-(oxan-4-yl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | SC12-0129 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-ethyl-N-(oxan-4-yl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 396.53 |
| Molecular Formula: | C23 H32 N4 O2 |
| Smiles: | CCn1ccc(C(N(CCCN2CCc3ccccc3C2)C2CCOCC2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.4002 |
| logD: | 1.4751 |
| logSw: | -2.3277 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.339 |
| InChI Key: | XIYJHIMZYXLACN-UHFFFAOYSA-N |