rel-(1R,3S,6R)-N-methyl-1-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-6-carboxamide
Chemical Structure Depiction of
rel-(1R,3S,6R)-N-methyl-1-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-6-carboxamide
rel-(1R,3S,6R)-N-methyl-1-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-6-carboxamide
Compound characteristics
| Compound ID: | SC65-0401 |
| Compound Name: | rel-(1R,3S,6R)-N-methyl-1-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-6-carboxamide |
| Molecular Weight: | 426.6 |
| Molecular Formula: | C25 H38 N4 O2 |
| Smiles: | [H][C@@]1(C[C@@]12C[C@@H](C(NC)=O)N(CC(C)C)C2)C(N1CCN(CC1)Cc1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.8918 |
| logD: | 0.3518 |
| logSw: | -2.4531 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.677 |
| InChI Key: | NUZMRHKEBWVDIB-SLSDLSHTSA-N |