rel-(1R,3S,6R)-N~1~-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-N~6~-methyl-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-1,6-dicarboxamide
Chemical Structure Depiction of
rel-(1R,3S,6R)-N~1~-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-N~6~-methyl-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-1,6-dicarboxamide
rel-(1R,3S,6R)-N~1~-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-N~6~-methyl-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-1,6-dicarboxamide
Compound characteristics
| Compound ID: | SC65-0436 |
| Compound Name: | rel-(1R,3S,6R)-N~1~-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-N~6~-methyl-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-1,6-dicarboxamide |
| Molecular Weight: | 473.63 |
| Molecular Formula: | C26 H40 F N5 O2 |
| Smiles: | [H][C@@]1(C[C@@]12C[C@@H](C(NC)=O)N(CC(C)C)C2)C(NCCCN1CCN(CC1)c1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.6388 |
| logD: | 0.1842 |
| logSw: | -2.2817 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.986 |
| InChI Key: | OCLMJASIQVITLC-PLXFJCCSSA-N |