N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-2-phenoxyacetamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-2-phenoxyacetamide
N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-2-phenoxyacetamide
Compound characteristics
| Compound ID: | S823-0317 |
| Compound Name: | N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-2-phenoxyacetamide |
| Molecular Weight: | 328.37 |
| Molecular Formula: | C17 H20 N4 O3 |
| Smiles: | C1[C@H]([C@@H](CN1c1ccncn1)CO)NC(COc1ccccc1)=O |
| Stereo: | RELATIVE |
| logP: | 0.9476 |
| logD: | 0.947 |
| logSw: | -1.3043 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.315 |
| InChI Key: | MVNJMASEGAGYOX-HIFRSBDPSA-N |