2-(2,5-dimethoxyphenyl)-1-{rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}ethan-1-one
Chemical Structure Depiction of
2-(2,5-dimethoxyphenyl)-1-{rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}ethan-1-one
2-(2,5-dimethoxyphenyl)-1-{rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}ethan-1-one
Compound characteristics
| Compound ID: | SC85-0015 |
| Compound Name: | 2-(2,5-dimethoxyphenyl)-1-{rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}ethan-1-one |
| Molecular Weight: | 476.58 |
| Molecular Formula: | C27 H32 N4 O4 |
| Smiles: | Cc1cccc(c1)c1nc([C@@H]2CN(C[C@@]23CCN(C)C3)C(Cc2cc(ccc2OC)OC)=O)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.3345 |
| logD: | 0.955 |
| logSw: | -4.4969 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.869 |
| InChI Key: | AWHSTQYBMOICQD-AMGIVPHBSA-N |