N-[rel-(3R,4S)-1-[(3,5-dimethoxyphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-[(3,5-dimethoxyphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide
N-[rel-(3R,4S)-1-[(3,5-dimethoxyphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide
Compound characteristics
| Compound ID: | S823-3004 |
| Compound Name: | N-[rel-(3R,4S)-1-[(3,5-dimethoxyphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide |
| Molecular Weight: | 348.44 |
| Molecular Formula: | C19 H28 N2 O4 |
| Smiles: | COc1cc(CN2C[C@H]([C@@H](C2)CO)NC(C2CCC2)=O)cc(c1)OC |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.6988 |
| logD: | -4.4468 |
| logSw: | -1.4027 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.266 |
| InChI Key: | LSWCJGCYUGHELN-QAPCUYQASA-N |