N-[rel-(3R,4S)-1-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide
N-[rel-(3R,4S)-1-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide
Compound characteristics
| Compound ID: | S823-3271 |
| Compound Name: | N-[rel-(3R,4S)-1-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide |
| Molecular Weight: | 320.43 |
| Molecular Formula: | C17 H28 N4 O2 |
| Smiles: | CCn1cc(CN2C[C@H]([C@@H](C2)CO)NC(C2CCC2)=O)c(C)n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.6123 |
| logD: | -7.2927 |
| logSw: | -0.7012 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.034 |
| InChI Key: | LURGKDFVZUWMCI-CVEARBPZSA-N |