2-(benzyloxy)-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-2-yl)pyrrolidin-3-yl]acetamide
Chemical Structure Depiction of
2-(benzyloxy)-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-2-yl)pyrrolidin-3-yl]acetamide
2-(benzyloxy)-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-2-yl)pyrrolidin-3-yl]acetamide
Compound characteristics
Compound ID: | S823-2028 |
Compound Name: | 2-(benzyloxy)-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-2-yl)pyrrolidin-3-yl]acetamide |
Molecular Weight: | 342.4 |
Molecular Formula: | C18 H22 N4 O3 |
Smiles: | C1[C@H]([C@@H](CN1c1ncccn1)CO)NC(COCc1ccccc1)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 1.0591 |
logD: | 1.0591 |
logSw: | -1.5485 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.959 |
InChI Key: | VHEWTYHSHWGKTP-CVEARBPZSA-N |