9-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-4-{2-[(pyridin-4-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecane
Chemical Structure Depiction of
9-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-4-{2-[(pyridin-4-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecane
9-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-4-{2-[(pyridin-4-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecane
Compound characteristics
| Compound ID: | S726-1450 |
| Compound Name: | 9-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-4-{2-[(pyridin-4-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecane |
| Molecular Weight: | 435.54 |
| Molecular Formula: | C21 H29 N3 O5 S |
| Smiles: | Cc1c(c(C)on1)S(N1CCC2(CC1)CC(CCOc1ccncc1)CCO2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1117 |
| logD: | 2.1114 |
| logSw: | -2.2771 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.164 |
| InChI Key: | JCBWDONZHPRGEW-GOSISDBHSA-N |