N-{[rel-(1R,4R)-bicyclo[2.2.1]hept-5-en-2-yl]methyl}-1-(pyrimidin-2-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-{[rel-(1R,4R)-bicyclo[2.2.1]hept-5-en-2-yl]methyl}-1-(pyrimidin-2-yl)piperidine-3-carboxamide
N-{[rel-(1R,4R)-bicyclo[2.2.1]hept-5-en-2-yl]methyl}-1-(pyrimidin-2-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | Y041-7098 |
| Compound Name: | N-{[rel-(1R,4R)-bicyclo[2.2.1]hept-5-en-2-yl]methyl}-1-(pyrimidin-2-yl)piperidine-3-carboxamide |
| Molecular Weight: | 312.41 |
| Molecular Formula: | C18 H24 N4 O |
| Smiles: | [H][C@@]12CC(CNC(C3CCCN(C3)c3ncccn3)=O)[C@@]([H])(C1)C=C2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6728 |
| logD: | 2.6727 |
| logSw: | -2.6535 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.245 |
| InChI Key: | UUOJGTNVRHNESQ-UHFFFAOYSA-N |