rel-(4R,5R)-2-(propane-2-sulfonyl)-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-6-oxa-2,9-diazaspiro[4.5]decan-10-one
Chemical Structure Depiction of
rel-(4R,5R)-2-(propane-2-sulfonyl)-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-6-oxa-2,9-diazaspiro[4.5]decan-10-one
rel-(4R,5R)-2-(propane-2-sulfonyl)-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-6-oxa-2,9-diazaspiro[4.5]decan-10-one
Compound characteristics
| Compound ID: | SC77-0830 |
| Compound Name: | rel-(4R,5R)-2-(propane-2-sulfonyl)-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-6-oxa-2,9-diazaspiro[4.5]decan-10-one |
| Molecular Weight: | 452.53 |
| Molecular Formula: | C19 H28 N6 O5 S |
| Smiles: | CC(C)S(N1C[C@H](C(N2CCN(CC2)c2ncccn2)=O)[C@]2(C1)C(NCCO2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.1481 |
| logD: | 0.1481 |
| logSw: | -2.1948 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.638 |
| InChI Key: | VEXDINHHCNCAOL-BEFAXECRSA-N |