5-(3-chloro-4-methoxyphenyl)-N-{[rel-(1R,9aS)-octahydro-2H-quinolizin-1-yl]methyl}-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
5-(3-chloro-4-methoxyphenyl)-N-{[rel-(1R,9aS)-octahydro-2H-quinolizin-1-yl]methyl}-1H-pyrazole-4-carboxamide
5-(3-chloro-4-methoxyphenyl)-N-{[rel-(1R,9aS)-octahydro-2H-quinolizin-1-yl]methyl}-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | Y043-5962 |
| Compound Name: | 5-(3-chloro-4-methoxyphenyl)-N-{[rel-(1R,9aS)-octahydro-2H-quinolizin-1-yl]methyl}-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 402.92 |
| Molecular Formula: | C21 H27 Cl N4 O2 |
| Smiles: | COc1ccc(cc1[Cl])c1c(cn[nH]1)C(NC[C@@H]1CCCN2CCCC[C@H]12)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6635 |
| logD: | 0.2258 |
| logSw: | -3.5782 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.823 |
| InChI Key: | LNQHBBQGMXBOHP-QAPCUYQASA-N |