rel-(1R,3S,6R)-1-(3,4-dihydroquinoline-1(2H)-carbonyl)-N-methyl-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-6-carboxamide
Chemical Structure Depiction of
rel-(1R,3S,6R)-1-(3,4-dihydroquinoline-1(2H)-carbonyl)-N-methyl-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-6-carboxamide
rel-(1R,3S,6R)-1-(3,4-dihydroquinoline-1(2H)-carbonyl)-N-methyl-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-6-carboxamide
Compound characteristics
| Compound ID: | SC65-0481 |
| Compound Name: | rel-(1R,3S,6R)-1-(3,4-dihydroquinoline-1(2H)-carbonyl)-N-methyl-5-(2-methylpropyl)-5-azaspiro[2.4]heptane-6-carboxamide |
| Molecular Weight: | 369.51 |
| Molecular Formula: | C22 H31 N3 O2 |
| Smiles: | [H][C@@]1(C[C@@]12C[C@@H](C(NC)=O)N(CC(C)C)C2)C(N1CCCc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3043 |
| logD: | 0.8206 |
| logSw: | -2.74 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.801 |
| InChI Key: | VSIFJDIBRWKLEE-JLMWRMLUSA-N |