3-(benzenesulfonyl)-1-{4-[(pyrimidin-2-yl)oxy]-1-oxa-9-azaspiro[5.5]undecan-9-yl}propan-1-one
Chemical Structure Depiction of
3-(benzenesulfonyl)-1-{4-[(pyrimidin-2-yl)oxy]-1-oxa-9-azaspiro[5.5]undecan-9-yl}propan-1-one
3-(benzenesulfonyl)-1-{4-[(pyrimidin-2-yl)oxy]-1-oxa-9-azaspiro[5.5]undecan-9-yl}propan-1-one
Compound characteristics
| Compound ID: | SA57-0033 |
| Compound Name: | 3-(benzenesulfonyl)-1-{4-[(pyrimidin-2-yl)oxy]-1-oxa-9-azaspiro[5.5]undecan-9-yl}propan-1-one |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C22 H27 N3 O5 S |
| Smiles: | C1COC2(CCN(CC2)C(CCS(c2ccccc2)(=O)=O)=O)CC1Oc1ncccn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7309 |
| logD: | 0.7309 |
| logSw: | -2.0556 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.495 |
| InChI Key: | CEERVZGXTUTTOF-GOSISDBHSA-N |