rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-[(4-methyl-1,3-thiazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane
Chemical Structure Depiction of
rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-[(4-methyl-1,3-thiazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane
rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-[(4-methyl-1,3-thiazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane
Compound characteristics
| Compound ID: | SC85-0058 |
| Compound Name: | rel-(4R,5R)-7-methyl-4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-[(4-methyl-1,3-thiazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane |
| Molecular Weight: | 409.55 |
| Molecular Formula: | C22 H27 N5 O S |
| Smiles: | Cc1cccc(c1)c1nc([C@@H]2CN(Cc3c(C)ncs3)C[C@@]23CCN(C)C3)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.8162 |
| logD: | 0.5409 |
| logSw: | -3.93 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.511 |
| InChI Key: | IJRGCUBMQFPUFB-GCJKJVERSA-N |