2-[9-(3-fluorobenzene-1-sulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[9-(3-fluorobenzene-1-sulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-(pyrrolidin-1-yl)ethan-1-one
2-[9-(3-fluorobenzene-1-sulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | S511-1227 |
| Compound Name: | 2-[9-(3-fluorobenzene-1-sulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 424.53 |
| Molecular Formula: | C21 H29 F N2 O4 S |
| Smiles: | C1CCN(C1)C(CC1CCOC2(CCN(CC2)S(c2cccc(c2)F)(=O)=O)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0364 |
| logD: | 3.0364 |
| logSw: | -3.4787 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.038 |
| InChI Key: | JXSVAKWPBQIFPS-KRWDZBQOSA-N |