1'-ethyl-3',5'-dimethyl-N-{[rel-(1R,9aS)-octahydro-2H-quinolizin-1-yl]methyl}-1'H,2H-[3,4'-bipyrazole]-5-carboxamide
Chemical Structure Depiction of
1'-ethyl-3',5'-dimethyl-N-{[rel-(1R,9aS)-octahydro-2H-quinolizin-1-yl]methyl}-1'H,2H-[3,4'-bipyrazole]-5-carboxamide
1'-ethyl-3',5'-dimethyl-N-{[rel-(1R,9aS)-octahydro-2H-quinolizin-1-yl]methyl}-1'H,2H-[3,4'-bipyrazole]-5-carboxamide
Compound characteristics
| Compound ID: | Y043-3392 |
| Compound Name: | 1'-ethyl-3',5'-dimethyl-N-{[rel-(1R,9aS)-octahydro-2H-quinolizin-1-yl]methyl}-1'H,2H-[3,4'-bipyrazole]-5-carboxamide |
| Molecular Weight: | 384.52 |
| Molecular Formula: | C21 H32 N6 O |
| Smiles: | CCn1c(C)c(c(C)n1)c1cc(C(NC[C@H]2CCCN3CCCC[C@@H]23)=O)n[nH]1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.2509 |
| logD: | -1.1868 |
| logSw: | -1.8715 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.77 |
| InChI Key: | OMWBHPIRMTYQED-UHFFFAOYSA-N |