[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]{rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}methanone
Chemical Structure Depiction of
[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]{rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}methanone
[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]{rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}methanone
Compound characteristics
| Compound ID: | SC85-0008 |
| Compound Name: | [1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]{rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}methanone |
| Molecular Weight: | 477.61 |
| Molecular Formula: | C27 H35 N5 O3 |
| Smiles: | Cc1cccc(c1)c1nc([C@@H]2CN(C[C@@]23CCN(C)C3)C(c2cc(C)n(CCOC)c2C)=O)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.5874 |
| logD: | 0.2659 |
| logSw: | -3.6758 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.736 |
| InChI Key: | HAOVPOUBWMVPME-KCWPFWIISA-N |