1-{rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}-2-[1-(propan-2-yl)piperidin-4-yl]ethan-1-one
Chemical Structure Depiction of
1-{rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}-2-[1-(propan-2-yl)piperidin-4-yl]ethan-1-one
1-{rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}-2-[1-(propan-2-yl)piperidin-4-yl]ethan-1-one
Compound characteristics
| Compound ID: | SC85-0038 |
| Compound Name: | 1-{rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}-2-[1-(propan-2-yl)piperidin-4-yl]ethan-1-one |
| Molecular Weight: | 465.64 |
| Molecular Formula: | C27 H39 N5 O2 |
| Smiles: | CC(C)N1CCC(CC1)CC(N1C[C@@H](c2nc(c3cccc(C)c3)no2)[C@]2(CCN(C)C2)C1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.1871 |
| logD: | 0.8075 |
| logSw: | -4.3462 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.751 |
| InChI Key: | WLIUJYCFDRZFFT-KCWPFWIISA-N |