N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(2,4,5-trifluorophenyl)methyl]pyrrolidin-3-yl}cyclobutanecarboxamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(2,4,5-trifluorophenyl)methyl]pyrrolidin-3-yl}cyclobutanecarboxamide
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(2,4,5-trifluorophenyl)methyl]pyrrolidin-3-yl}cyclobutanecarboxamide
Compound characteristics
| Compound ID: | S823-2982 |
| Compound Name: | N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(2,4,5-trifluorophenyl)methyl]pyrrolidin-3-yl}cyclobutanecarboxamide |
| Molecular Weight: | 342.36 |
| Molecular Formula: | C17 H21 F3 N2 O2 |
| Smiles: | C1CC(C1)C(N[C@@H]1CN(Cc2cc(c(cc2F)F)F)C[C@H]1CO)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0943 |
| logD: | -0.1284 |
| logSw: | -1.6388 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.179 |
| InChI Key: | IOTKWWUDPLNLMV-BLLLJJGKSA-N |