rel-(1R,3S,6R)-N~1~-[(3,4-dimethylphenyl)methyl]-N~6~-methyl-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-1,6-dicarboxamide
Chemical Structure Depiction of
rel-(1R,3S,6R)-N~1~-[(3,4-dimethylphenyl)methyl]-N~6~-methyl-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-1,6-dicarboxamide
rel-(1R,3S,6R)-N~1~-[(3,4-dimethylphenyl)methyl]-N~6~-methyl-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-1,6-dicarboxamide
Compound characteristics
| Compound ID: | SC65-0488 |
| Compound Name: | rel-(1R,3S,6R)-N~1~-[(3,4-dimethylphenyl)methyl]-N~6~-methyl-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-1,6-dicarboxamide |
| Molecular Weight: | 371.52 |
| Molecular Formula: | C22 H33 N3 O2 |
| Smiles: | [H][C@@]1(C[C@@]12C[C@@H](C(NC)=O)N(CC(C)C)C2)C(NCc1ccc(C)c(C)c1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3419 |
| logD: | 0.8873 |
| logSw: | -2.7451 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.902 |
| InChI Key: | ZLXMLZGJBZRPMH-IPJJNNNSSA-N |