N-[rel-(3R,4S)-1-[(3-ethoxyphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]pyridine-3-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-[(3-ethoxyphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]pyridine-3-carboxamide
N-[rel-(3R,4S)-1-[(3-ethoxyphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | S823-7451 |
| Compound Name: | N-[rel-(3R,4S)-1-[(3-ethoxyphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]pyridine-3-carboxamide |
| Molecular Weight: | 355.44 |
| Molecular Formula: | C20 H25 N3 O3 |
| Smiles: | CCOc1cccc(CN2C[C@H]([C@@H](C2)CO)NC(c2cccnc2)=O)c1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.1498 |
| logD: | -1.6445 |
| logSw: | -1.4877 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.297 |
| InChI Key: | OCNGTKAUAGWWOQ-MJGOQNOKSA-N |