N-[rel-(3R,4S)-1-[(2-cyanophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]pyridine-3-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-[(2-cyanophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]pyridine-3-carboxamide
N-[rel-(3R,4S)-1-[(2-cyanophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | S823-7061 |
| Compound Name: | N-[rel-(3R,4S)-1-[(2-cyanophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]pyridine-3-carboxamide |
| Molecular Weight: | 336.39 |
| Molecular Formula: | C19 H20 N4 O2 |
| Smiles: | C(c1ccccc1C#N)N1C[C@H]([C@@H](C1)CO)NC(c1cccnc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.5263 |
| logD: | -0.035 |
| logSw: | -1.5812 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.23 |
| InChI Key: | GXEZKPRFOIMFAX-MSOLQXFVSA-N |