rel-(1R,3S,6R)-5-(benzenesulfonyl)-N~6~-methyl-N~1~-[2-(1H-pyrazol-1-yl)ethyl]-5-azaspiro[2.4]heptane-1,6-dicarboxamide
Chemical Structure Depiction of
rel-(1R,3S,6R)-5-(benzenesulfonyl)-N~6~-methyl-N~1~-[2-(1H-pyrazol-1-yl)ethyl]-5-azaspiro[2.4]heptane-1,6-dicarboxamide
rel-(1R,3S,6R)-5-(benzenesulfonyl)-N~6~-methyl-N~1~-[2-(1H-pyrazol-1-yl)ethyl]-5-azaspiro[2.4]heptane-1,6-dicarboxamide
Compound characteristics
| Compound ID: | SC65-0916 |
| Compound Name: | rel-(1R,3S,6R)-5-(benzenesulfonyl)-N~6~-methyl-N~1~-[2-(1H-pyrazol-1-yl)ethyl]-5-azaspiro[2.4]heptane-1,6-dicarboxamide |
| Molecular Weight: | 431.51 |
| Molecular Formula: | C20 H25 N5 O4 S |
| Smiles: | [H][C@@]1(C[C@@]12C[C@@H](C(NC)=O)N(C2)S(c1ccccc1)(=O)=O)C(NCCn1cccn1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.4851 |
| logD: | -0.4851 |
| logSw: | -2.1736 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.834 |
| InChI Key: | GPAPYWVBAJFUOL-ZWOKBUDYSA-N |