2-[9-(methanesulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-[4-(pyrimidin-2-yl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[9-(methanesulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-[4-(pyrimidin-2-yl)piperazin-1-yl]ethan-1-one
2-[9-(methanesulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-[4-(pyrimidin-2-yl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S511-2729 |
| Compound Name: | 2-[9-(methanesulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-[4-(pyrimidin-2-yl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 437.56 |
| Molecular Formula: | C20 H31 N5 O4 S |
| Smiles: | CS(N1CCC2(CC1)CC(CCO2)CC(N1CCN(CC1)c1ncccn1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.281 |
| logD: | 1.281 |
| logSw: | -1.8788 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.059 |
| InChI Key: | BLOZJSVVNKLUFA-KRWDZBQOSA-N |