N-methyl-N-(2-{5-[1-(2-methylbenzene-1-sulfonyl)azetidin-3-yl]-1,2,4-oxadiazol-3-yl}ethyl)oxane-4-carboxamide
Chemical Structure Depiction of
N-methyl-N-(2-{5-[1-(2-methylbenzene-1-sulfonyl)azetidin-3-yl]-1,2,4-oxadiazol-3-yl}ethyl)oxane-4-carboxamide
N-methyl-N-(2-{5-[1-(2-methylbenzene-1-sulfonyl)azetidin-3-yl]-1,2,4-oxadiazol-3-yl}ethyl)oxane-4-carboxamide
Compound characteristics
| Compound ID: | S699-1045 |
| Compound Name: | N-methyl-N-(2-{5-[1-(2-methylbenzene-1-sulfonyl)azetidin-3-yl]-1,2,4-oxadiazol-3-yl}ethyl)oxane-4-carboxamide |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C21 H28 N4 O5 S |
| Smiles: | Cc1ccccc1S(N1CC(C1)c1nc(CCN(C)C(C2CCOCC2)=O)no1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0124 |
| logD: | 2.0124 |
| logSw: | -2.3238 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 89.045 |
| InChI Key: | HOPXUPDTLWWACA-UHFFFAOYSA-N |