9-(benzenesulfonyl)-4-{[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]methyl}-1-oxa-9-azaspiro[5.5]undecane
Chemical Structure Depiction of
9-(benzenesulfonyl)-4-{[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]methyl}-1-oxa-9-azaspiro[5.5]undecane
9-(benzenesulfonyl)-4-{[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]methyl}-1-oxa-9-azaspiro[5.5]undecane
Compound characteristics
| Compound ID: | S687-1340 |
| Compound Name: | 9-(benzenesulfonyl)-4-{[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]methyl}-1-oxa-9-azaspiro[5.5]undecane |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C23 H26 N4 O4 S |
| Smiles: | C1COC2(CCN(CC2)S(c2ccccc2)(=O)=O)CC1Cc1nc(c2ccncc2)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.678 |
| logD: | 3.6779 |
| logSw: | -4.0139 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.051 |
| InChI Key: | ZWIGGPUNIIJIAV-SFHVURJKSA-N |