2-[1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-oxobutan-2-yl]-1,2-benzothiazol-3(2H)-one
Chemical Structure Depiction of
2-[1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-oxobutan-2-yl]-1,2-benzothiazol-3(2H)-one
2-[1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-oxobutan-2-yl]-1,2-benzothiazol-3(2H)-one
Compound characteristics
| Compound ID: | E022-0951 |
| Compound Name: | 2-[1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-oxobutan-2-yl]-1,2-benzothiazol-3(2H)-one |
| Molecular Weight: | 362.45 |
| Molecular Formula: | C18 H22 N2 O4 S |
| Smiles: | CCC(C(N1CCC2(CC1)OCCO2)=O)N1C(c2ccccc2S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9359 |
| logD: | 1.9359 |
| logSw: | -2.5028 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.469 |
| InChI Key: | JFLKPXUCJWFXDI-AWEZNQCLSA-N |