4-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-2-[(2-fluorophenyl)methylidene]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
4-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-2-[(2-fluorophenyl)methylidene]-2H-1,4-benzothiazin-3(4H)-one
4-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-2-[(2-fluorophenyl)methylidene]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C312-0527 |
| Compound Name: | 4-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-2-[(2-fluorophenyl)methylidene]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 454.52 |
| Molecular Formula: | C24 H23 F N2 O4 S |
| Smiles: | C1CN(CCC12OCCO2)C(CN1C(/C(=C/c2ccccc2F)Sc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2377 |
| logD: | 3.2377 |
| logSw: | -3.4623 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.899 |
| InChI Key: | GXUWNGGBBLZZQO-UHFFFAOYSA-N |