N-[rel-(3R,4R)-4-(hydroxymethyl)-1-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}piperidin-3-yl]benzamide
Chemical Structure Depiction of
N-[rel-(3R,4R)-4-(hydroxymethyl)-1-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}piperidin-3-yl]benzamide
N-[rel-(3R,4R)-4-(hydroxymethyl)-1-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}piperidin-3-yl]benzamide
Compound characteristics
| Compound ID: | S617-0589 |
| Compound Name: | N-[rel-(3R,4R)-4-(hydroxymethyl)-1-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}piperidin-3-yl]benzamide |
| Molecular Weight: | 424.42 |
| Molecular Formula: | C20 H23 F3 N4 O3 |
| Smiles: | Cc1cc(C(F)(F)F)nn1CC(N1CC[C@H](CO)[C@@H](C1)NC(c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.9922 |
| logD: | 0.9922 |
| logSw: | -2.1021 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.945 |
| InChI Key: | LLEPOGXFWNXVPF-CVEARBPZSA-N |