(1-ethyl-5-methyl-1H-pyrazol-4-yl)[rel-(3R,4R)-3-(hydroxymethyl)-4-(pyridin-2-yl)pyrrolidin-1-yl]methanone
Chemical Structure Depiction of
(1-ethyl-5-methyl-1H-pyrazol-4-yl)[rel-(3R,4R)-3-(hydroxymethyl)-4-(pyridin-2-yl)pyrrolidin-1-yl]methanone
(1-ethyl-5-methyl-1H-pyrazol-4-yl)[rel-(3R,4R)-3-(hydroxymethyl)-4-(pyridin-2-yl)pyrrolidin-1-yl]methanone
Compound characteristics
| Compound ID: | S831-2397 |
| Compound Name: | (1-ethyl-5-methyl-1H-pyrazol-4-yl)[rel-(3R,4R)-3-(hydroxymethyl)-4-(pyridin-2-yl)pyrrolidin-1-yl]methanone |
| Molecular Weight: | 314.39 |
| Molecular Formula: | C17 H22 N4 O2 |
| Smiles: | CCn1c(C)c(cn1)C(N1C[C@@H](CO)[C@@H](C1)c1ccccn1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.3842 |
| logD: | 0.3842 |
| logSw: | -2.1208 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.936 |
| InChI Key: | FRIGOTLOPIJJCP-DZGCQCFKSA-N |