2-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethylidene]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethylidene]-2H-1,4-benzothiazin-3(4H)-one
2-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethylidene]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C306-0588 |
| Compound Name: | 2-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethylidene]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 346.4 |
| Molecular Formula: | C17 H18 N2 O4 S |
| Smiles: | C1CN(CCC12OCCO2)C(/C=C1/C(Nc2ccccc2S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2528 |
| logD: | 1.2528 |
| logSw: | -2.2521 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.674 |
| InChI Key: | MKXUVZSOISHSMZ-UHFFFAOYSA-N |