N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]pyrrolidin-3-yl}pyrazine-2-carboxamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]pyrrolidin-3-yl}pyrazine-2-carboxamide
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]pyrrolidin-3-yl}pyrazine-2-carboxamide
Compound characteristics
| Compound ID: | S823-6927 |
| Compound Name: | N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]pyrrolidin-3-yl}pyrazine-2-carboxamide |
| Molecular Weight: | 342.4 |
| Molecular Formula: | C18 H22 N4 O3 |
| Smiles: | COc1ccc(CN2C[C@H]([C@@H](C2)CO)NC(c2cnccn2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.1972 |
| logD: | -1.242 |
| logSw: | -1.2123 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.765 |
| InChI Key: | XTPPTJXRCFHFNW-PBHICJAKSA-N |