1-{rel-(4R,5R)-7-methyl-4-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of
1-{rel-(4R,5R)-7-methyl-4-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}-2-(thiophen-2-yl)ethan-1-one
1-{rel-(4R,5R)-7-methyl-4-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}-2-(thiophen-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | SC85-0824 |
| Compound Name: | 1-{rel-(4R,5R)-7-methyl-4-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-2,7-diazaspiro[4.4]nonan-2-yl}-2-(thiophen-2-yl)ethan-1-one |
| Molecular Weight: | 410.5 |
| Molecular Formula: | C20 H22 N6 O2 S |
| Smiles: | CN1CC[C@]2(C1)CN(C[C@H]2c1nc(c2cnccn2)no1)C(Cc1cccs1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.308 |
| logD: | -2.0716 |
| logSw: | -1.7154 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.279 |
| InChI Key: | VKCPDYVSDQVDJI-QRWLVFNGSA-N |