N-{rel-(3R,4R)-4-(hydroxymethyl)-1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carbonyl]piperidin-3-yl}-2-methoxyacetamide
Chemical Structure Depiction of
N-{rel-(3R,4R)-4-(hydroxymethyl)-1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carbonyl]piperidin-3-yl}-2-methoxyacetamide
N-{rel-(3R,4R)-4-(hydroxymethyl)-1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carbonyl]piperidin-3-yl}-2-methoxyacetamide
Compound characteristics
| Compound ID: | S617-0287 |
| Compound Name: | N-{rel-(3R,4R)-4-(hydroxymethyl)-1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carbonyl]piperidin-3-yl}-2-methoxyacetamide |
| Molecular Weight: | 381.47 |
| Molecular Formula: | C19 H31 N3 O5 |
| Smiles: | Cc1cc(C(N2CC[C@H](CO)[C@@H](C2)NC(COC)=O)=O)c(C)n1CCOC |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.456 |
| logD: | -0.456 |
| logSw: | -1.5576 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.268 |
| InChI Key: | IDTORTLOHGTTDS-WBVHZDCISA-N |