N-(5-{2-[4-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)phenyl]ethenyl}-3-methyl-1,2-oxazol-4-yl)propanamide
Chemical Structure Depiction of
N-(5-{2-[4-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)phenyl]ethenyl}-3-methyl-1,2-oxazol-4-yl)propanamide
N-(5-{2-[4-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)phenyl]ethenyl}-3-methyl-1,2-oxazol-4-yl)propanamide
Compound characteristics
| Compound ID: | M026-0463 |
| Compound Name: | N-(5-{2-[4-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)phenyl]ethenyl}-3-methyl-1,2-oxazol-4-yl)propanamide |
| Molecular Weight: | 461.54 |
| Molecular Formula: | C22 H27 N3 O6 S |
| Smiles: | CCC(Nc1c(C)noc1/C=C\c1ccc(cc1)S(N1CCC2(CC1)OCCO2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0166 |
| logD: | 2.0163 |
| logSw: | -2.7434 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.656 |
| InChI Key: | YVSUUAIFCBQRMQ-UHFFFAOYSA-N |