3-(benzenesulfonyl)-1-{4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}propan-1-one
Chemical Structure Depiction of
3-(benzenesulfonyl)-1-{4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}propan-1-one
3-(benzenesulfonyl)-1-{4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}propan-1-one
Compound characteristics
| Compound ID: | SC42-0007 |
| Compound Name: | 3-(benzenesulfonyl)-1-{4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}propan-1-one |
| Molecular Weight: | 447.55 |
| Molecular Formula: | C22 H29 N3 O5 S |
| Smiles: | Cc1nc(CC2CCOC3(CCN(CC3)C(CCS(c3ccccc3)(=O)=O)=O)C2)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6886 |
| logD: | 1.6886 |
| logSw: | -2.2866 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.893 |
| InChI Key: | VSDHVSBFNVEDRQ-SFHVURJKSA-N |