2-(azepan-1-yl)-1-[6-(ethanesulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]ethan-1-one
Chemical Structure Depiction of
2-(azepan-1-yl)-1-[6-(ethanesulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]ethan-1-one
2-(azepan-1-yl)-1-[6-(ethanesulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]ethan-1-one
Compound characteristics
| Compound ID: | SB57-0344 |
| Compound Name: | 2-(azepan-1-yl)-1-[6-(ethanesulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]ethan-1-one |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C19 H31 N5 O4 S |
| Smiles: | CCS(N1CC(c2nc(C)no2)C2(CN(C2)C(CN2CCCCCC2)=O)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6469 |
| logD: | -2.0691 |
| logSw: | -1.511 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.021 |
| InChI Key: | NYHRJCBWYQMYAF-INIZCTEOSA-N |