N-(5-{2-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-4-methoxyphenyl]ethenyl}-3-methyl-1,2-oxazol-4-yl)acetamide
Chemical Structure Depiction of
N-(5-{2-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-4-methoxyphenyl]ethenyl}-3-methyl-1,2-oxazol-4-yl)acetamide
N-(5-{2-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-4-methoxyphenyl]ethenyl}-3-methyl-1,2-oxazol-4-yl)acetamide
Compound characteristics
| Compound ID: | L991-0781 |
| Compound Name: | N-(5-{2-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-4-methoxyphenyl]ethenyl}-3-methyl-1,2-oxazol-4-yl)acetamide |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C22 H27 N3 O7 S |
| Smiles: | CC(Nc1c(C)noc1/C=C\c1ccc(c(c1)S(N1CCC2(CC1)OCCO2)(=O)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0521 |
| logD: | 1.052 |
| logSw: | -2.4043 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.398 |
| InChI Key: | MLWJTLMZARJFIF-UHFFFAOYSA-N |