rel-(1R,3S,6R)-N~1~-(2-methoxyethyl)-N~6~-methyl-5-(2-methylpropyl)-N~1~-[(thiophen-2-yl)methyl]-5-azaspiro[2.4]heptane-1,6-dicarboxamide
Chemical Structure Depiction of
rel-(1R,3S,6R)-N~1~-(2-methoxyethyl)-N~6~-methyl-5-(2-methylpropyl)-N~1~-[(thiophen-2-yl)methyl]-5-azaspiro[2.4]heptane-1,6-dicarboxamide
rel-(1R,3S,6R)-N~1~-(2-methoxyethyl)-N~6~-methyl-5-(2-methylpropyl)-N~1~-[(thiophen-2-yl)methyl]-5-azaspiro[2.4]heptane-1,6-dicarboxamide
Compound characteristics
| Compound ID: | SC65-0433 |
| Compound Name: | rel-(1R,3S,6R)-N~1~-(2-methoxyethyl)-N~6~-methyl-5-(2-methylpropyl)-N~1~-[(thiophen-2-yl)methyl]-5-azaspiro[2.4]heptane-1,6-dicarboxamide |
| Molecular Weight: | 407.57 |
| Molecular Formula: | C21 H33 N3 O3 S |
| Smiles: | [H][C@@]1(C[C@@]12C[C@@H](C(NC)=O)N(CC(C)C)C2)C(N(CCOC)Cc1cccs1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.634 |
| logD: | 0.094 |
| logSw: | -2.3903 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.039 |
| InChI Key: | YDKCVEJLNWQMHY-OPYAIIAOSA-N |