rel-(1R,3S,6R)-5-(benzenesulfonyl)-1-[4-(methoxymethyl)piperidine-1-carbonyl]-N-methyl-5-azaspiro[2.4]heptane-6-carboxamide
Chemical Structure Depiction of
rel-(1R,3S,6R)-5-(benzenesulfonyl)-1-[4-(methoxymethyl)piperidine-1-carbonyl]-N-methyl-5-azaspiro[2.4]heptane-6-carboxamide
rel-(1R,3S,6R)-5-(benzenesulfonyl)-1-[4-(methoxymethyl)piperidine-1-carbonyl]-N-methyl-5-azaspiro[2.4]heptane-6-carboxamide
Compound characteristics
| Compound ID: | SC65-0946 |
| Compound Name: | rel-(1R,3S,6R)-5-(benzenesulfonyl)-1-[4-(methoxymethyl)piperidine-1-carbonyl]-N-methyl-5-azaspiro[2.4]heptane-6-carboxamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C22 H31 N3 O5 S |
| Smiles: | [H][C@@]1(C[C@@]12C[C@@H](C(NC)=O)N(C2)S(c1ccccc1)(=O)=O)C(N1CCC(CC1)COC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.8729 |
| logD: | 0.8729 |
| logSw: | -2.4358 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.879 |
| InChI Key: | VNHHVSMBNAQPCN-IPJJNNNSSA-N |