rel-(1R,3S,6R)-N~1~-cyclopentyl-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~-cyclopentyl-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~-cyclopentyl-N~6~-methyl-5-(2-methylpropyl)-N~1~-[(thiophen-2-yl)methyl]-5-azaspiro[2.4]heptane-1,6-dicarboxamide
Compound characteristics
| Compound ID: | SC65-0413 |
| Compound Name: | rel-(1R,3S,6R)-N~1~-cyclopentyl-N~6~-methyl-5-(2-methylpropyl)-N~1~-[(thiophen-2-yl)methyl]-5-azaspiro[2.4]heptane-1,6-dicarboxamide |
| Molecular Weight: | 417.61 |
| Molecular Formula: | C23 H35 N3 O2 S |
| Smiles: | [H][C@@]1(C[C@@]12C[C@@H](C(NC)=O)N(CC(C)C)C2)C(N(Cc1cccs1)C1CCCC1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9264 |
| logD: | 1.3865 |
| logSw: | -3.1838 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.057 |
| InChI Key: | YAPVSOXRQIDSIM-VIZSFHNOSA-N |