N-[rel-(3R,4S)-1-[(4-cyanophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]pyridine-4-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-[(4-cyanophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]pyridine-4-carboxamide
N-[rel-(3R,4S)-1-[(4-cyanophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]pyridine-4-carboxamide
Compound characteristics
| Compound ID: | S823-3739 |
| Compound Name: | N-[rel-(3R,4S)-1-[(4-cyanophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]pyridine-4-carboxamide |
| Molecular Weight: | 336.39 |
| Molecular Formula: | C19 H20 N4 O2 |
| Smiles: | C(c1ccc(C#N)cc1)N1C[C@H]([C@@H](C1)CO)NC(c1ccncc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.3004 |
| logD: | -0.6069 |
| logSw: | -0.9929 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.14 |
| InChI Key: | ZLALFKDHXLVJFQ-MSOLQXFVSA-N |