2-[9-(2,5-dimethoxybenzene-1-sulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[9-(2,5-dimethoxybenzene-1-sulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-(pyrrolidin-1-yl)ethan-1-one
2-[9-(2,5-dimethoxybenzene-1-sulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | S511-1230 |
| Compound Name: | 2-[9-(2,5-dimethoxybenzene-1-sulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 466.6 |
| Molecular Formula: | C23 H34 N2 O6 S |
| Smiles: | COc1ccc(c(c1)S(N1CCC2(CC1)CC(CCO2)CC(N1CCCC1)=O)(=O)=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7677 |
| logD: | 2.7677 |
| logSw: | -3.3336 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 70.212 |
| InChI Key: | MSBNDTBKKKCJPL-SFHVURJKSA-N |