rel-(1R,3S,6R)-N~6~-methyl-N~1~-[(5-methylfuran-2-yl)methyl]-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-1,6-dicarboxamide
Chemical Structure Depiction of
rel-(1R,3S,6R)-N~6~-methyl-N~1~-[(5-methylfuran-2-yl)methyl]-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-1,6-dicarboxamide
rel-(1R,3S,6R)-N~6~-methyl-N~1~-[(5-methylfuran-2-yl)methyl]-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-1,6-dicarboxamide
Compound characteristics
| Compound ID: | SC65-0460 |
| Compound Name: | rel-(1R,3S,6R)-N~6~-methyl-N~1~-[(5-methylfuran-2-yl)methyl]-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-1,6-dicarboxamide |
| Molecular Weight: | 347.46 |
| Molecular Formula: | C19 H29 N3 O3 |
| Smiles: | [H][C@@]1(C[C@@]12C[C@@H](C(NC)=O)N(CC(C)C)C2)C(NCc1ccc(C)o1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3796 |
| logD: | -0.075 |
| logSw: | -2.0164 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.165 |
| InChI Key: | NTJBHIADQCXLOG-BXWFABGCSA-N |